(2E)-4-(5-acetyl-2-hydroxyphenyl)-2-methylbut-2-enal - Compound Card

(2E)-4-(5-acetyl-2-hydroxyphenyl)-2-methylbut-2-enal

Select a section from the left sidebar

(2E)-4-(5-acetyl-2-hydroxyphenyl)-2-methylbut-2-enal

Structure
Zoomed Structure
  • Family: Plantae - Asteraceae
  • Kingdom: Plantae
  • Class: Ketone
Canonical Smiles O=C/C(=C/Cc1cc(ccc1O)C(=O)C)/C
InChI InChI=1S/C13H14O3/c1-9(8-14)3-4-12-7-11(10(2)15)5-6-13(12)16/h3,5-8,16H,4H2,1-2H3/b9-3+
InChIKey ZDMKUBRRBGKXQT-YCRREMRBSA-N
Formula C13H14O3
HBA 3
HBD 1
MW 218.25
Rotatable Bonds 4
TPSA 54.37
LogP 2.28
Number Rings 1
Number Aromatic Rings 1
Heavy Atom Count 16
Formal Charge 0
Fraction CSP3 0.23
Exact Mass 218.09
Number of Lipinski Rule Violations 0
# Species Family Kingdom NCBI Taxonomy ID
1 Artemisia monosperma Asteraceae Plantae 72348

Showing of synonyms

  • Abdel-Mogib M, Dawidar AM, et al. (1990). p-Coumarinic acid derivatives from Artemisia monosperma.. Phytochemistry,1990,29(8),2728-2729. [View]
Pubchem: 14730829
Nmrshiftdb2: 60070695

No compound-protein relationship available.

Structure

SMILES: c1ccccc1

Level: 0

Mol. Weight: 218.25 g/mol

No bioactivities available.

Absorption

Caco-2 (logPapp)
-4.49
Human Oral Bioavailability 20%
Bioavailable
Human Intestinal Absorption
Absorbed
Madin-Darby Canine Kidney
-4.31
Human Oral Bioavailability 50%
Bioavailable
P-Glycoprotein Inhibitor
Non-Inhibitor
P-Glycoprotein Substrate
Non-Substrate
Skin Permeability
-2.2

Distribution

Blood-Brain Barrier (CNS)
-
Blood-Brain Barrier
Non-Penetrable
Fraction Unbound (Human)
0.32
Plasma Protein Binding
35.29
Steady State Volume of Distribution
-

Metabolism

Breast Cancer Resistance Protein
Non-Inhibitor
CYP 1A2 Inhibitor
Non-Inhibitor
CYP 1A2 Substrate
Non-Substrate
CYP 2C19 Inhibitor
Non-Inhibitor
CYP 2C19 Substrate
Non-Substrate
CYP 2C9 Inhibitor
Non-Inhibitor
CYP 2C9 Substrate
Substrate
CYP 2D6 Inhibitor
Non-Inhibitor
CYP 2D6 Substrate
Non-Substrate
CYP 3A4 Inhibitor
Non-Inhibitor
CYP 3A4 Substrate
Non-Substrate
OATP1B1
Non-Inhibitor
OATP1B3
Non-Inhibitor

Excretion

Clearance
6.79
Organic Cation Transporter 2
Non-Inhibitor
Half-Life of Drug
-

Toxicity

AMES Mutagenesis
Safe
Avian
Safe
Bee
Safe
Bioconcentration Factor
0.04
Biodegradation
Toxic
Carcinogenesis
Safe
Crustacean
Safe
Liver Injury I (DILI)
Safe
Eye Corrosion
Safe
Eye Irritation
Toxic
Maximum Tolerated Dose
1.06
Liver Injury II
Safe
hERG Blockers
Safe
Daphnia Maga
5.66
Micronucleos
Safe
NR-AhR
Safe
NR-AR
Safe
NR-AR-LBD
Safe
NR-Aromatase
Safe
NR-ER
Safe
NR-ER-LBD
Safe
NR-GR
Safe
NR-PPAR-gamma
Safe
NR-TR
Safe
T. Pyriformis
4.45
Rat (Acute)
1.79
Rat (Chronic Oral)
1.95
Fathead Minnow
4.44
Respiratory Disease
Safe
Skin Sensitisation
Toxic
SR-ARE
Safe
SR-ATAD5
Safe
SR-HSE
Safe
SR-MMP
Safe
SR-p53
Safe

General Properties

Boiling Point
328.75
Hydration Free Energy
-10.18
Log(D) at pH=7.4
1.49
Log(P)
2.1
Log S
-2.34
Log(Vapor Pressure)
-5.09
Melting Point
118.92
pKa Acid
7.55
pKa Basic
4.69
Protein Name UniProt ID Entry Name Species #Pharmacophore Points Probability (0.7 ≤ Tversky Score ≤ 1.0)
NADPH dehydrogenase 1 Q02899 OYE1_SACPS Saccharomyces pastorianus 3 0.9712
NADPH dehydrogenase 1 Q02899 OYE1_SACPS Saccharomyces pastorianus 3 0.9712
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.9667
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.9667
Trans-1,2-dihydrobenzene-1,2-diol dehydrogenase Q9TQS6 DHDH_MACFA Macaca fascicularis 3 0.9665
Trans-1,2-dihydrobenzene-1,2-diol dehydrogenase Q9TQS6 DHDH_MACFA Macaca fascicularis 3 0.9665
Flavoredoxin Q72HI0 Q72HI0_THET2 Thermus thermophilus 3 0.9593
Flavoredoxin Q72HI0 Q72HI0_THET2 Thermus thermophilus 3 0.9593
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.9569
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.9569
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 3 0.9292
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 3 0.9292
S-norcoclaurine synthase Q67A25 NCS_THLFG Thalictrum flavum subsp. glaucum 3 0.9254
S-norcoclaurine synthase Q67A25 NCS_THLFG Thalictrum flavum subsp. glaucum 3 0.9254
Tetracycline repressor protein class H P51561 TETR8_PASMD Pasteurella multocida 3 0.9079
Tetracycline repressor protein class H P51561 TETR8_PASMD Pasteurella multocida 3 0.9079
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.8938
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.8938
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.8800
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.8800
ADP-ribosylation factor 1 P84077 ARF1_HUMAN Homo sapiens 2 0.8795
ADP-ribosylation factor 1 P84077 ARF1_HUMAN Homo sapiens 2 0.8795
Photosynthetic reaction center cytochrome c subunit P07173 CYCR_BLAVI Blastochloris viridis 3 0.8440
Photosynthetic reaction center cytochrome c subunit P07173 CYCR_BLAVI Blastochloris viridis 3 0.8440
Photosynthetic reaction center cytochrome c subunit P07173 CYCR_BLAVI Blastochloris viridis 3 0.8415
Photosynthetic reaction center cytochrome c subunit P07173 CYCR_BLAVI Blastochloris viridis 3 0.8415
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.8171
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.8171
rRNA methylase Q8DSS3 Q8DSS3_STRMU Streptococcus mutans serotype c 2 0.8167
rRNA methylase Q8DSS3 Q8DSS3_STRMU Streptococcus mutans serotype c 2 0.8167
Thymidylate synthase P0A884 TYSY_ECOLI Escherichia coli 2 0.7966
Thymidylate synthase P0A884 TYSY_ECOLI Escherichia coli 2 0.7966
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.7922
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.7922
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform P48736 PK3CG_HUMAN Homo sapiens 3 0.7831
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform P48736 PK3CG_HUMAN Homo sapiens 3 0.7831
Orotidine 5'-phosphate decarboxylase Q5L0U0 PYRF_GEOKA Geobacillus kaustophilus 3 0.7759
Orotidine 5'-phosphate decarboxylase Q5L0U0 PYRF_GEOKA Geobacillus kaustophilus 3 0.7759
Tannase B3Y018 B3Y018_LACPN Lactiplantibacillus plantarum 3 0.7723
Tannase B3Y018 B3Y018_LACPN Lactiplantibacillus plantarum 3 0.7723
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7711
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7711
Peroxidase C1A P00433 PER1A_ARMRU Armoracia rusticana 2 0.7675
Peroxidase C1A P00433 PER1A_ARMRU Armoracia rusticana 2 0.7675
APH(2'')-Id O68183 O68183_ENTCA Enterococcus casseliflavus 3 0.7671
APH(2'')-Id O68183 O68183_ENTCA Enterococcus casseliflavus 3 0.7671
Pancreatic alpha-amylase P04746 AMYP_HUMAN Homo sapiens 2 0.7669
Pancreatic alpha-amylase P04746 AMYP_HUMAN Homo sapiens 2 0.7669
Endoplasmin P41148 ENPL_CANLF Canis lupus familiaris 4 0.7625
Endoplasmin P41148 ENPL_CANLF Canis lupus familiaris 4 0.7625
ADP-ribosylation factor 1 P84080 ARF1_BOVIN Bos taurus 2 0.7603
ADP-ribosylation factor 1 P84080 ARF1_BOVIN Bos taurus 2 0.7603
Glucan 1,3-beta-glucosidase P29717 EXG1_CANAL Candida albicans 2 0.7600
Glucan 1,3-beta-glucosidase P29717 EXG1_CANAL Candida albicans 2 0.7600
Glucan 1,3-beta-glucosidase P29717 EXG1_CANAL Candida albicans 2 0.7594
Glucan 1,3-beta-glucosidase P29717 EXG1_CANAL Candida albicans 2 0.7594
N-acetyltransferase domain-containing protein Q9HV14 Q9HV14_PSEAE Pseudomonas aeruginosa 3 0.7554
N-acetyltransferase domain-containing protein Q9HV14 Q9HV14_PSEAE Pseudomonas aeruginosa 3 0.7554
Beta-galactoside alpha-2,6-sialyltransferase 1 P15907 SIAT1_HUMAN Homo sapiens 3 0.7548
Beta-galactoside alpha-2,6-sialyltransferase 1 P15907 SIAT1_HUMAN Homo sapiens 3 0.7548
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 3 0.7524
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 3 0.7524
LIM domain kinase 1 P53667 LIMK1_HUMAN Homo sapiens 2 0.7517
LIM domain kinase 1 P53667 LIMK1_HUMAN Homo sapiens 2 0.7517
Eukaryotic translation initiation factor 4E type 3 Q9DBB5 IF4E3_MOUSE Mus musculus 3 0.7516
Eukaryotic translation initiation factor 4E type 3 Q9DBB5 IF4E3_MOUSE Mus musculus 3 0.7516
Tannase B3Y018 B3Y018_LACPN Lactiplantibacillus plantarum 3 0.7512
Tannase B3Y018 B3Y018_LACPN Lactiplantibacillus plantarum 3 0.7512
Chorismate mutase AroH P19080 AROH_BACSU Bacillus subtilis 2 0.7506
Chorismate mutase AroH P19080 AROH_BACSU Bacillus subtilis 2 0.7506
RNA-dependent RNA polymerase Q6A562 Q6A562_9VIRU Thosea asigna virus 2 0.7499
RNA-dependent RNA polymerase Q6A562 Q6A562_9VIRU Thosea asigna virus 2 0.7499
Nuclear receptor subfamily 4immunitygroup A member 1 P22736 NR4A1_HUMAN Homo sapiens 2 0.7494
Nuclear receptor subfamily 4immunitygroup A member 1 P22736 NR4A1_HUMAN Homo sapiens 2 0.7494
Lactotransferrin P24627 TRFL_BOVIN Bos taurus 2 0.7475
Lactotransferrin P24627 TRFL_BOVIN Bos taurus 2 0.7475
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 2 0.7474
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 2 0.7474
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 2 0.7465
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 2 0.7465
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 2 0.7451
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 2 0.7451
Glycogen synthase kinase-3 beta P49841 GSK3B_HUMAN Homo sapiens 2 0.7443
Glycogen synthase kinase-3 beta P49841 GSK3B_HUMAN Homo sapiens 2 0.7443
Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase Q05603 COBT_SALTY Salmonella typhimurium 2 0.7439
Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase Q05603 COBT_SALTY Salmonella typhimurium 2 0.7439
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7422
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7422
3',5'-cyclic-AMP phosphodiesterase 4B Q07343 PDE4B_HUMAN Homo sapiens 3 0.7413
Mitogen-activated protein kinase 1 P28482 MK01_HUMAN Homo sapiens 2 0.7413
Mitogen-activated protein kinase 1 P28482 MK01_HUMAN Homo sapiens 2 0.7413
3',5'-cyclic-AMP phosphodiesterase 4B Q07343 PDE4B_HUMAN Homo sapiens 3 0.7413
cGMP-dependent protein kinase 1 Q13976 KGP1_HUMAN Homo sapiens 3 0.7407
cGMP-dependent protein kinase 1 Q13976 KGP1_HUMAN Homo sapiens 3 0.7407
Endothiapepsin P11838 CARP_CRYPA Cryphonectria parasitica 2 0.7405
Endothiapepsin P11838 CARP_CRYPA Cryphonectria parasitica 2 0.7405
Mitochondrial poly(A) polymerase F1NBW0 F1NBW0_CHICK Gallus gallus 2 0.7398
Mitochondrial poly(A) polymerase F1NBW0 F1NBW0_CHICK Gallus gallus 2 0.7398
Flavin-dependent monooxygenase Q93L51 TETX_BACT4 Bacteroides thetaiotaomicron 2 0.7393
Flavin-dependent monooxygenase Q93L51 TETX_BACT4 Bacteroides thetaiotaomicron 2 0.7393
Liver carboxylesterase 1 P23141 EST1_HUMAN Homo sapiens 2 0.7366
Liver carboxylesterase 1 P23141 EST1_HUMAN Homo sapiens 2 0.7366
ADP compounds hydrolase NudE P45799 NUDE_ECOLI Escherichia coli 2 0.7357
ADP compounds hydrolase NudE P45799 NUDE_ECOLI Escherichia coli 2 0.7357
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 2 0.7356
UDP-N-acetylmuramoyl-L-alanyl-D-glutamate--LD-lysine ligase Q9WY79 MURE_THEMA Thermotoga maritima 3 0.7356
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 2 0.7356
UDP-N-acetylmuramoyl-L-alanyl-D-glutamate--LD-lysine ligase Q9WY79 MURE_THEMA Thermotoga maritima 3 0.7356
Alpha-ketoglutarate-dependent dioxygenase FTO Q9C0B1 FTO_HUMAN Homo sapiens 2 0.7355
Alpha-ketoglutarate-dependent dioxygenase FTO Q9C0B1 FTO_HUMAN Homo sapiens 2 0.7355
Plasma membrane ATPase Q42932 Q42932_NICPL Nicotiana plumbaginifolia 2 0.7349
Plasma membrane ATPase Q42932 Q42932_NICPL Nicotiana plumbaginifolia 2 0.7349
Kynurenine/alpha-aminoadipate aminotransferase, mitochondrial Q8N5Z0 AADAT_HUMAN Homo sapiens 2 0.7348
Kynurenine/alpha-aminoadipate aminotransferase, mitochondrial Q8N5Z0 AADAT_HUMAN Homo sapiens 2 0.7348
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7346
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7346
Catalase-peroxidase Q3JNW6 KATG_BURP1 Burkholderia pseudomallei 2 0.7340
Catalase-peroxidase Q3JNW6 KATG_BURP1 Burkholderia pseudomallei 2 0.7340
2-phospho-L-lactate transferase Q8PVT6 COFD_METMA Methanosarcina mazei 2 0.7339
2-phospho-L-lactate transferase Q8PVT6 COFD_METMA Methanosarcina mazei 2 0.7339
Metallo-beta-lactamase type 2 P26918 BLAB_AERHY Aeromonas hydrophila 2 0.7338
Metallo-beta-lactamase type 2 P26918 BLAB_AERHY Aeromonas hydrophila 2 0.7338
Genome polyprotein Q2YHF0 POLG_DEN4T Dengue virus type 4 3 0.7337
Genome polyprotein Q2YHF0 POLG_DEN4T Dengue virus type 4 3 0.7337
Biflaviolin synthase CYP158A1 Q9KZF5 C1581_STRCO Streptomyces coelicolor / M145) 2 0.7336
Biflaviolin synthase CYP158A1 Q9KZF5 C1581_STRCO Streptomyces coelicolor / M145) 2 0.7336
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 2 0.7335
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 2 0.7335
Phosphatidylinositol 5-phosphate 4-kinase type-2 beta P78356 PI42B_HUMAN Homo sapiens 3 0.7332
Phosphatidylinositol 5-phosphate 4-kinase type-2 beta P78356 PI42B_HUMAN Homo sapiens 3 0.7332
3'-5' exoribonuclease Rv2179c P9WJ73 EXRBN_MYCTU Mycobacterium tuberculosis 2 0.7331
3'-5' exoribonuclease Rv2179c P9WJ73 EXRBN_MYCTU Mycobacterium tuberculosis 2 0.7331
Single-strand selective monofunctional uracil DNA glycosylase Q9YGN6 SMUG1_XENLA Xenopus laevis 3 0.7328
Single-strand selective monofunctional uracil DNA glycosylase Q9YGN6 SMUG1_XENLA Xenopus laevis 3 0.7328
cGMP-dependent 3',5'-cyclic phosphodiesterase O00408 PDE2A_HUMAN Homo sapiens 3 0.7317
cGMP-dependent 3',5'-cyclic phosphodiesterase O00408 PDE2A_HUMAN Homo sapiens 3 0.7317
Beta-1 adrenergic receptor P07700 ADRB1_MELGA Meleagris gallopavo 2 0.7309
Beta-1 adrenergic receptor P07700 ADRB1_MELGA Meleagris gallopavo 2 0.7309
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 2 0.7295
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 2 0.7295
L-lactate dehydrogenase A chain P13491 LDHA_RABIT Oryctolagus cuniculus 2 0.7294
L-lactate dehydrogenase A chain P13491 LDHA_RABIT Oryctolagus cuniculus 2 0.7294
Purine nucleoside phosphorylase P55859 PNPH_BOVIN Bos taurus 2 0.7291
Purine nucleoside phosphorylase P55859 PNPH_BOVIN Bos taurus 2 0.7291
Succinate dehydrogenase [ubiquinone] flavoprotein subunit, mitochondrial Q0QF01 SDHA_PIG Sus scrofa 2 0.7283
Succinate dehydrogenase [ubiquinone] flavoprotein subunit, mitochondrial Q0QF01 SDHA_PIG Sus scrofa 2 0.7283
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 3 0.7275
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 3 0.7275
11-beta-hydroxysteroid dehydrogenase 1 P28845 DHI1_HUMAN Homo sapiens 2 0.7269
11-beta-hydroxysteroid dehydrogenase 1 P28845 DHI1_HUMAN Homo sapiens 2 0.7269
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 2 0.7267
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 2 0.7267
Ephrin type-B receptor 2 P54763 EPHB2_MOUSE Mus musculus 2 0.7265
Ephrin type-B receptor 2 P54763 EPHB2_MOUSE Mus musculus 2 0.7265
Avidin P02701 AVID_CHICK Gallus gallus 2 0.7263
Avidin P02701 AVID_CHICK Gallus gallus 2 0.7263
Pyridoxal kinase O00764 PDXK_HUMAN Homo sapiens 2 0.7262
Pyridoxal kinase O00764 PDXK_HUMAN Homo sapiens 2 0.7262
2-phospho-L-lactate transferase Q8PVT6 COFD_METMA Methanosarcina mazei 2 0.7260
2-phospho-L-lactate transferase Q8PVT6 COFD_METMA Methanosarcina mazei 2 0.7260
Alpha/beta hydrolase fold A5VAT9 A5VAT9_SPHWW Sphingomonas wittichii 2 0.7257
Alpha/beta hydrolase fold A5VAT9 A5VAT9_SPHWW Sphingomonas wittichii 2 0.7257
Soluble cytochrome b562 P0ABE7 C562_ECOLX Escherichia coli 2 0.7255
Soluble cytochrome b562 P0ABE7 C562_ECOLX Escherichia coli 2 0.7255
Aldo-keto reductase family 1 member B1 P15121 ALDR_HUMAN Homo sapiens 2 0.7254
Aldo-keto reductase family 1 member B1 P15121 ALDR_HUMAN Homo sapiens 2 0.7254
Non-receptor tyrosine-protein kinase TYK2 P29597 TYK2_HUMAN Homo sapiens 2 0.7252
Non-receptor tyrosine-protein kinase TYK2 P29597 TYK2_HUMAN Homo sapiens 2 0.7252
Pentaerythritol tetranitrate reductase P71278 P71278_ENTCL Enterobacter cloacae 2 0.7250
Pentaerythritol tetranitrate reductase P71278 P71278_ENTCL Enterobacter cloacae 2 0.7250
3-alpha-(or 20-beta)-hydroxysteroid dehydrogenase P19992 HSD_STREX Streptomyces exfoliatus 2 0.7247
3-alpha-(or 20-beta)-hydroxysteroid dehydrogenase P19992 HSD_STREX Streptomyces exfoliatus 2 0.7247
Metallophosphoesterase A3DJ38 A3DJ38_HUNT2 Clostridium thermocellum 2 0.7242
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 2 0.7242
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 2 0.7242
Metallophosphoesterase A3DJ38 A3DJ38_HUNT2 Clostridium thermocellum 2 0.7242
2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoate hydrolase P47229 BPHD_PARXL Paraburkholderia xenovorans 2 0.7240
2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoate hydrolase P47229 BPHD_PARXL Paraburkholderia xenovorans 2 0.7240
Multidrug efflux pump subunit AcrB P31224 ACRB_ECOLI Escherichia coli 3 0.7236
Multidrug efflux pump subunit AcrB P31224 ACRB_ECOLI Escherichia coli 3 0.7236
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 2 0.7235
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 2 0.7235
Toluene-4-monooxygenase system, hydroxylase component subunit alpha Q00456 TMOA_PSEME Pseudomonas mendocina 2 0.7231
Toluene-4-monooxygenase system, hydroxylase component subunit alpha Q00456 TMOA_PSEME Pseudomonas mendocina 2 0.7231
Glutamate receptor 2 P19491 GRIA2_RAT Rattus norvegicus 2 0.7228
Mitogen-activated protein kinase kinase kinase 5 Q99683 M3K5_HUMAN Homo sapiens 2 0.7228
Mitogen-activated protein kinase kinase kinase 5 Q99683 M3K5_HUMAN Homo sapiens 2 0.7228
Glutamate receptor 2 P19491 GRIA2_RAT Rattus norvegicus 2 0.7228
Nucleoside permease Q9KPL5 Q9KPL5_VIBCH Vibrio cholerae serotype O1 3 0.7227
Nucleoside permease Q9KPL5 Q9KPL5_VIBCH Vibrio cholerae serotype O1 3 0.7227
Avidin P02701 AVID_CHICK Gallus gallus 2 0.7226
Avidin P02701 AVID_CHICK Gallus gallus 2 0.7226
Beta-glucosidase 12 B8AVF0 BGL12_ORYSI Oryza sativa subsp. indica 2 0.7224
Beta-glucosidase 12 B8AVF0 BGL12_ORYSI Oryza sativa subsp. indica 2 0.7224
Sulfotransferase 1A1 P50225 ST1A1_HUMAN Homo sapiens 2 0.7222
Sulfotransferase 1A1 P50225 ST1A1_HUMAN Homo sapiens 2 0.7222
2-aminohexano-6-lactam racemase Q7M181 ACLR_ACHOB Achromobacter obae 2 0.7219
N-terminal acetyltransferase A complex subunit NAT1 P12945 NAT1_YEAST Saccharomyces cerevisiae 2 0.7219
N-terminal acetyltransferase A complex subunit NAT1 P12945 NAT1_YEAST Saccharomyces cerevisiae 2 0.7219
2-aminohexano-6-lactam racemase Q7M181 ACLR_ACHOB Achromobacter obae 2 0.7219
Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2 O88703 HCN2_MOUSE Mus musculus 3 0.7213
Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2 O88703 HCN2_MOUSE Mus musculus 3 0.7213
Capsid protein Q9WBP8 Q9WBP8_9VIRU Adeno-associated virus - 1 2 0.7204
Capsid protein Q9WBP8 Q9WBP8_9VIRU Adeno-associated virus - 1 2 0.7204
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7203
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7203
D-alanyl-D-alanine carboxypeptidase P15555 DAC_STRSR Streptomyces sp 2 0.7202
D-alanyl-D-alanine carboxypeptidase P15555 DAC_STRSR Streptomyces sp 2 0.7202
Fibroblast growth factor receptor 2 P21802 FGFR2_HUMAN Homo sapiens 2 0.7198
Fibroblast growth factor receptor 2 P21802 FGFR2_HUMAN Homo sapiens 2 0.7198
Benzoylformate decarboxylase P20906 MDLC_PSEPU Pseudomonas putida 3 0.7189
Benzoylformate decarboxylase P20906 MDLC_PSEPU Pseudomonas putida 3 0.7189
Glucose-1-phosphate thymidylyltransferase Q9AGY4 Q9AGY4_ANETH Aneurinibacillus thermoaerophilus 3 0.7188
Glucose-1-phosphate thymidylyltransferase Q9AGY4 Q9AGY4_ANETH Aneurinibacillus thermoaerophilus 3 0.7188
cAMP-dependent protein kinase catalytic subunit alpha P05132 KAPCA_MOUSE Mus musculus 2 0.7184
cAMP-dependent protein kinase catalytic subunit alpha P05132 KAPCA_MOUSE Mus musculus 2 0.7184
Fibroblast growth factor receptor 2 P21802 FGFR2_HUMAN Homo sapiens 2 0.7183
Fibroblast growth factor receptor 2 P21802 FGFR2_HUMAN Homo sapiens 2 0.7183
Methionine aminopeptidase P0AE18 MAP1_ECOLI Escherichia coli 2 0.7180
Methionine aminopeptidase P0AE18 MAP1_ECOLI Escherichia coli 2 0.7180
11-beta-hydroxysteroid dehydrogenase 1 P28845 DHI1_HUMAN Homo sapiens 2 0.7178
Tryptophan synthase alpha chain P00929 TRPA_SALTY Salmonella typhimurium 2 0.7178
Tryptophan synthase alpha chain P00929 TRPA_SALTY Salmonella typhimurium 2 0.7178
11-beta-hydroxysteroid dehydrogenase 1 P28845 DHI1_HUMAN Homo sapiens 2 0.7178
5'-methylthioadenosine/S-adenosylhomocysteine nucleosidase Q81LL4 MTNN_BACAN Bacillus anthracis 2 0.7175
5'-methylthioadenosine/S-adenosylhomocysteine nucleosidase Q81LL4 MTNN_BACAN Bacillus anthracis 2 0.7175
Cyclin-dependent kinase 8 P49336 CDK8_HUMAN Homo sapiens 2 0.7173
Glutamate receptor 2 P19491 GRIA2_RAT Rattus norvegicus 2 0.7173
Cyclin-dependent kinase 8 P49336 CDK8_HUMAN Homo sapiens 2 0.7173
Glutamate receptor 2 P19491 GRIA2_RAT Rattus norvegicus 2 0.7173
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 2 0.7164
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 2 0.7164
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7162
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7162
ATP-dependent molecular chaperone HSP82 P02829 HSP82_YEAST Saccharomyces cerevisiae 2 0.7159
ATP-dependent molecular chaperone HSP82 P02829 HSP82_YEAST Saccharomyces cerevisiae 2 0.7159
Protein UshA P07024 USHA_ECOLI Escherichia coli 2 0.7158
Protein UshA P07024 USHA_ECOLI Escherichia coli 2 0.7158
cAMP-dependent protein kinase type I-alpha regulatory subunit P00514 KAP0_BOVIN Bos taurus 2 0.7154
cAMP-dependent protein kinase type I-alpha regulatory subunit P00514 KAP0_BOVIN Bos taurus 2 0.7154
Bifunctional epoxide hydrolase 2 P34913 HYES_HUMAN Homo sapiens 2 0.7153
Bifunctional epoxide hydrolase 2 P34913 HYES_HUMAN Homo sapiens 2 0.7153
Cyclic GMP-AMP phosphodiesterase SMPDL3A Q92484 ASM3A_HUMAN Homo sapiens 2 0.7149
Cyclic GMP-AMP phosphodiesterase SMPDL3A Q92484 ASM3A_HUMAN Homo sapiens 2 0.7149
Serine/threonine-protein kinase SKY1 Q03656 SKY1_YEAST Saccharomyces cerevisiae 2 0.7147
Serine/threonine-protein kinase SKY1 Q03656 SKY1_YEAST Saccharomyces cerevisiae 2 0.7147
Class 10 plant pathogenesis-related protein 2B Q9LLQ2 P102B_LUPLU Lupinus luteus 2 0.7142
Class 10 plant pathogenesis-related protein 2B Q9LLQ2 P102B_LUPLU Lupinus luteus 2 0.7142
Endothiapepsin P11838 CARP_CRYPA Cryphonectria parasitica 2 0.7141
Endothiapepsin P11838 CARP_CRYPA Cryphonectria parasitica 2 0.7141
Glutamate receptor 2 P19491 GRIA2_RAT Rattus norvegicus 2 0.7135
Glutamate receptor 2 P19491 GRIA2_RAT Rattus norvegicus 2 0.7135
Phenylalanine-4-hydroxylase P00439 PH4H_HUMAN Homo sapiens 2 0.7130
Phenylalanine-4-hydroxylase P00439 PH4H_HUMAN Homo sapiens 2 0.7130
NAD-capped RNA hydrolase NudC P32664 NUDC_ECOLI Escherichia coli 2 0.7129
NAD-capped RNA hydrolase NudC P32664 NUDC_ECOLI Escherichia coli 2 0.7129
UDP-galactopyranose mutase Q48485 GLF1_KLEPN Klebsiella pneumoniae 3 0.7126
NADPH-dependent 7-cyano-7-deazaguanine reductase Q9KTK0 QUEF_VIBCH Vibrio cholerae serotype O1 3 0.7126
Biotin carboxylase P24182 ACCC_ECOLI Escherichia coli 2 0.7126
UDP-galactopyranose mutase Q48485 GLF1_KLEPN Klebsiella pneumoniae 3 0.7126
NADPH-dependent 7-cyano-7-deazaguanine reductase Q9KTK0 QUEF_VIBCH Vibrio cholerae serotype O1 3 0.7126
Biotin carboxylase P24182 ACCC_ECOLI Escherichia coli 2 0.7126
RIO-type serine/threonine-protein kinase Rio1 O28471 RIO1_ARCFU Archaeoglobus fulgidus 2 0.7125
RIO-type serine/threonine-protein kinase Rio1 O28471 RIO1_ARCFU Archaeoglobus fulgidus 2 0.7125
3-hydroxyanthranilate 3,4-dioxygenase Q1LCS4 3HAO_CUPMC Cupriavidus metallidurans 2 0.7124
3-hydroxyanthranilate 3,4-dioxygenase Q1LCS4 3HAO_CUPMC Cupriavidus metallidurans 2 0.7124
Nitric oxide synthase, inducible P29477 NOS2_MOUSE Mus musculus 2 0.7123
Nitric oxide synthase, inducible P29477 NOS2_MOUSE Mus musculus 2 0.7123
Proline iminopeptidase O32449 PIP_SERMA Serratia marcescens 2 0.7118
Proline iminopeptidase O32449 PIP_SERMA Serratia marcescens 2 0.7118
Chloramphenicol 3-O phosphotransferase Q56148 CPT_STRVP Streptomyces venezuelae 2 0.7116
Chloramphenicol 3-O phosphotransferase Q56148 CPT_STRVP Streptomyces venezuelae 2 0.7116
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 2 0.7114
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 2 0.7114
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 2 0.7110
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 2 0.7110
Casein kinase II subunit alpha P68400 CSK21_HUMAN Homo sapiens 2 0.7108
Vitamin D-binding protein P02774 VTDB_HUMAN Homo sapiens 2 0.7108
Casein kinase II subunit alpha P68400 CSK21_HUMAN Homo sapiens 2 0.7108
Vitamin D-binding protein P02774 VTDB_HUMAN Homo sapiens 2 0.7108
Aromatic-amino-acid aminotransferase P95468 TYRB_PARDE Paracoccus denitrificans 2 0.7105
Aromatic-amino-acid aminotransferase P95468 TYRB_PARDE Paracoccus denitrificans 2 0.7105
MAP kinase-activated protein kinase 2 P49137 MAPK2_HUMAN Homo sapiens 2 0.7104
Abscisic acid receptor PYL2 O80992 PYL2_ARATH Arabidopsis thaliana 2 0.7104
MAP kinase-activated protein kinase 2 P49137 MAPK2_HUMAN Homo sapiens 2 0.7104
Abscisic acid receptor PYL2 O80992 PYL2_ARATH Arabidopsis thaliana 2 0.7104
Ceramide transfer protein Q9Y5P4 CERT_HUMAN Homo sapiens 2 0.7097
Ceramide transfer protein Q9Y5P4 CERT_HUMAN Homo sapiens 2 0.7097
NAD-dependent protein deacetylase Q9WYW0 NPD_THEMA Thermotoga maritima 2 0.7097
NAD-dependent protein deacetylase Q9WYW0 NPD_THEMA Thermotoga maritima 2 0.7097
Myosin heavy chain kinase A P42527 MHCKA_DICDI Dictyostelium discoideum 2 0.7095
Myosin heavy chain kinase A P42527 MHCKA_DICDI Dictyostelium discoideum 2 0.7095
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7094
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7094
Type IV / VI secretion system DotU domain-containing protein Q9KN50 Q9KN50_VIBCH Vibrio cholerae serotype O1 2 0.7091
Type IV / VI secretion system DotU domain-containing protein Q9KN50 Q9KN50_VIBCH Vibrio cholerae serotype O1 2 0.7091
Proline iminopeptidase O32449 PIP_SERMA Serratia marcescens 2 0.7089
Proline iminopeptidase O32449 PIP_SERMA Serratia marcescens 2 0.7089
Norsolorinic acid synthase Q12053 AFLC_ASPPU Aspergillus parasiticus 2 0.7088
Norsolorinic acid synthase Q12053 AFLC_ASPPU Aspergillus parasiticus 2 0.7088
Pentaerythritol tetranitrate reductase P71278 P71278_ENTCL Enterobacter cloacae 2 0.7085
Pentaerythritol tetranitrate reductase P71278 P71278_ENTCL Enterobacter cloacae 2 0.7085
Cyclic AMP receptor protein Q5SID7 CRP_THET8 Thermus thermophilus 2 0.7083
Cyclic AMP receptor protein Q5SID7 CRP_THET8 Thermus thermophilus 2 0.7083
Glycogen synthase kinase-3 beta P49841 GSK3B_HUMAN Homo sapiens 2 0.7083
Glycogen synthase kinase-3 beta P49841 GSK3B_HUMAN Homo sapiens 2 0.7083
Hexokinase-4 P35557 HXK4_HUMAN Homo sapiens 2 0.7077
Hexokinase-4 P35557 HXK4_HUMAN Homo sapiens 2 0.7077
CCA-adding enzyme O28126 CCA_ARCFU Archaeoglobus fulgidus 2 0.7076
CCA-adding enzyme O28126 CCA_ARCFU Archaeoglobus fulgidus 2 0.7076
Inosine-5'-monophosphate dehydrogenase P50097 IMDH_TRIFO Tritrichomonas foetus 2 0.7075
L-lactate dehydrogenase (cytochrome) P00175 CYB2_YEAST Saccharomyces cerevisiae 2 0.7075
L-lactate dehydrogenase (cytochrome) P00175 CYB2_YEAST Saccharomyces cerevisiae 2 0.7075
Inosine-5'-monophosphate dehydrogenase P50097 IMDH_TRIFO Tritrichomonas foetus 2 0.7075
Nucleoside 2-deoxyribosyltransferase Q8RLY5 Q8RLY5_LACHE Lactobacillus helveticus 2 0.7072
Nucleoside 2-deoxyribosyltransferase Q8RLY5 Q8RLY5_LACHE Lactobacillus helveticus 2 0.7072
Nitric oxide synthase, inducible P29477 NOS2_MOUSE Mus musculus 2 0.7070
Nitric oxide synthase, inducible P29477 NOS2_MOUSE Mus musculus 2 0.7070
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 2 0.7066
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 2 0.7066
Pteridine reductase 1 Q01782 PTR1_LEIMA Leishmania major 2 0.7064
Pteridine reductase 1 Q01782 PTR1_LEIMA Leishmania major 2 0.7064
Proline iminopeptidase O32449 PIP_SERMA Serratia marcescens 2 0.7063
Proline iminopeptidase O32449 PIP_SERMA Serratia marcescens 2 0.7063
Nitric oxide synthase, inducible P29477 NOS2_MOUSE Mus musculus 2 0.7058
Nitric oxide synthase, inducible P29477 NOS2_MOUSE Mus musculus 2 0.7058
Uncharacterized protein YML079W Q03629 YMH9_YEAST Saccharomyces cerevisiae 2 0.7056
Uncharacterized protein YML079W Q03629 YMH9_YEAST Saccharomyces cerevisiae 2 0.7056
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 2 0.7053
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 2 0.7053
Adenylate cyclase type 5 P30803 ADCY5_CANLF Canis lupus familiaris 3 0.7051
Purine nucleoside phosphorylase DeoD-type O34925 DEOD_BACSU Bacillus subtilis 2 0.7051
Purine nucleoside phosphorylase DeoD-type O34925 DEOD_BACSU Bacillus subtilis 2 0.7051
Adenylate cyclase type 5 P30803 ADCY5_CANLF Canis lupus familiaris 3 0.7051
5'-methylthioadenosine/S-adenosylhomocysteine nucleosidase P0AF12 MTNN_ECOLI Escherichia coli 2 0.7049
5'-methylthioadenosine/S-adenosylhomocysteine nucleosidase P0AF12 MTNN_ECOLI Escherichia coli 2 0.7049
Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 Q9Y3Z3 SAMH1_HUMAN Homo sapiens 2 0.7048
Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 Q9Y3Z3 SAMH1_HUMAN Homo sapiens 2 0.7048
Mandelate racemase P11444 MANR_PSEPU Pseudomonas putida 2 0.7043
Mandelate racemase P11444 MANR_PSEPU Pseudomonas putida 2 0.7043
Endothiapepsin P11838 CARP_CRYPA Cryphonectria parasitica 2 0.7039
Endothiapepsin P11838 CARP_CRYPA Cryphonectria parasitica 2 0.7039
DNA gyrase subunit A P0AES5 GYRA_SHIFL Shigella flexneri 2 0.7038
DNA gyrase subunit A P0AES5 GYRA_SHIFL Shigella flexneri 2 0.7038
Nitric oxide synthase, inducible P29477 NOS2_MOUSE Mus musculus 2 0.7037
Nitric oxide synthase, inducible P29477 NOS2_MOUSE Mus musculus 2 0.7037
Putative FAD-dependent oxygenase EncM Q9KHK2 Q9KHK2_9ACTN Streptomyces maritimus 2 0.7035
Putative FAD-dependent oxygenase EncM Q9KHK2 Q9KHK2_9ACTN Streptomyces maritimus 2 0.7035
Polymerase acidic protein C3W5S0 C3W5S0_I09A0 Influenza A virus 2 0.7034
Polymerase acidic protein C3W5S0 C3W5S0_I09A0 Influenza A virus 2 0.7034
L-lactate dehydrogenase A chain P04642 LDHA_RAT Rattus norvegicus 2 0.7033
L-lactate dehydrogenase A chain P04642 LDHA_RAT Rattus norvegicus 2 0.7033
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 2 0.7030
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 2 0.7030
Biflaviolin synthase CYP158A2 Q9FCA6 C1582_STRCO Streptomyces coelicolor / M145) 2 0.7029
Biflaviolin synthase CYP158A2 Q9FCA6 C1582_STRCO Streptomyces coelicolor / M145) 2 0.7029
Acetolactate synthase, chloroplastic P17597 ILVB_ARATH Arabidopsis thaliana 2 0.7027
Acetolactate synthase, chloroplastic P17597 ILVB_ARATH Arabidopsis thaliana 2 0.7027
Protocatechuate 3,4-dioxygenase beta chain P00437 PCXB_PSEPU Pseudomonas putida 2 0.7026
Protocatechuate 3,4-dioxygenase beta chain P00437 PCXB_PSEPU Pseudomonas putida 2 0.7026
Diphtheria toxin P00588 DTX_CORBE Corynephage beta 2 0.7024
Diphtheria toxin P00588 DTX_CORBE Corynephage beta 2 0.7024
Amino-acid acetyltransferase Q5FAK7 Q5FAK7_NEIG1 Neisseria gonorrhoeae 2 0.7023
Amino-acid acetyltransferase Q5FAK7 Q5FAK7_NEIG1 Neisseria gonorrhoeae 2 0.7023
Serine/threonine-protein kinase Chk2 O96017 CHK2_HUMAN Homo sapiens 2 0.7020
Serine/threonine-protein kinase Chk2 O96017 CHK2_HUMAN Homo sapiens 2 0.7020
Guanylate kinase P15454 KGUA_YEAST Saccharomyces cerevisiae 3 0.7010
Guanylate kinase P15454 KGUA_YEAST Saccharomyces cerevisiae 3 0.7010
Inosine-5'-monophosphate dehydrogenase P50097 IMDH_TRIFO Tritrichomonas foetus 2 0.7005
Inosine-5'-monophosphate dehydrogenase P50097 IMDH_TRIFO Tritrichomonas foetus 2 0.7005

Download SDF