2-[penta-1,3-diyn-1-yl]-5-[acetoxy-3-chloro-but-1-yn-1-yl] thiophene - Compound Card

2-[penta-1,3-diyn-1-yl]-5-[acetoxy-3-chloro-but-1-yn-1-yl] thiophene

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2-[penta-1,3-diyn-1-yl]-5-[acetoxy-3-chloro-but-1-yn-1-yl] thiophene

Structure
Zoomed Structure
  • Family: Plantae - Asteraceae
  • Kingdom: Plantae
  • Class: Thiophene
Canonical Smiles CC#CC#Cc1ccc(s1)C#CC(COC(=O)C)Cl
InChI InChI=1S/C15H11ClO2S/c1-3-4-5-6-14-9-10-15(19-14)8-7-13(16)11-18-12(2)17/h9-10,13H,11H2,1-2H3
InChIKey ATXWWAJKDXZDBZ-UHFFFAOYSA-N
Formula C15H11ClO2S
HBA 3
HBD 0
MW 290.77
Rotatable Bonds 2
TPSA 26.3
LogP 2.64
Number Rings 1
Number Aromatic Rings 1
Heavy Atom Count 19
Formal Charge 0
Fraction CSP3 0.27
Exact Mass 290.02
Number of Lipinski Rule Violations 0
# Species Family Kingdom NCBI Taxonomy ID
1 Pluchea dioscoridis Asteraceae Plantae —
2 Escinops ellenbeckii Asteraceae Plantae —

Showing of synonyms

  • Hymete A, Rohloff J, et al. (2005). Acetylenic thiophenes from the roots of Escinops ellenbeckii from Ethiopia. Natural Product Research,2005,19(8),755-761. [View] [PubMed]
  • Bohlmann F, Metwally MA, et al. (1984). Eudesmanolides from Pluchea dioscoridis. Phytochemistry,1984,23(9),1975-1977. [View]
Pubchem: 13051301
Nmrshiftdb2: 70059455

No compound-protein relationship available.

Structure

SMILES: c1ccsc1

Level: 0

Mol. Weight: 290.77 g/mol

No bioactivities available.

Absorption

Caco-2 (logPapp)
-4.46
Human Oral Bioavailability 20%
Bioavailable
Human Intestinal Absorption
Absorbed
Madin-Darby Canine Kidney
-4.62
Human Oral Bioavailability 50%
Non-Bioavailable
P-Glycoprotein Inhibitor
Non-Inhibitor
P-Glycoprotein Substrate
Non-Substrate
Skin Permeability
-1.93

Distribution

Blood-Brain Barrier (CNS)
-
Blood-Brain Barrier
Penetrable
Fraction Unbound (Human)
1.43
Plasma Protein Binding
52.11
Steady State Volume of Distribution
-

Metabolism

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

Excretion

Clearance
9.83
Organic Cation Transporter 2
Non-Inhibitor
Half-Life of Drug
-

Toxicity

AMES Mutagenesis
Toxic
Avian
Safe
Bee
Toxic
Bioconcentration Factor
2.04
Biodegradation
Safe
Carcinogenesis
Toxic
Crustacean
Toxic
Liver Injury I (DILI)
Safe
Eye Corrosion
Safe
Eye Irritation
Toxic
Maximum Tolerated Dose
0.8
Liver Injury II
Toxic
hERG Blockers
Safe
Daphnia Maga
5.99
Micronucleos
Toxic
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
Toxic
T. Pyriformis
6.57
Rat (Acute)
2.42
Rat (Chronic Oral)
1.11
Fathead Minnow
5.03
Respiratory Disease
Toxic
Skin Sensitisation
Toxic
SR-ARE
Toxic
SR-ATAD5
Safe
SR-HSE
Safe
SR-MMP
Toxic
SR-p53
Safe

General Properties

Boiling Point
348.6
Hydration Free Energy
-5.57
Log(D) at pH=7.4
4.22
Log(P)
4.97
Log S
-4.84
Log(Vapor Pressure)
-4.98
Melting Point
51.09
pKa Acid
8.59
pKa Basic
-1.03
Protein Name UniProt ID Entry Name Species #Pharmacophore Points Probability (0.7 ≤ Tversky Score ≤ 1.0)
Class B acid phosphatase Q540U1 APHA_SALTM Salmonella typhimurium 2 0.8624
Class B acid phosphatase Q540U1 APHA_SALTM Salmonella typhimurium 2 0.8624
Aldo-keto reductase family 1 member C3 P42330 AK1C3_HUMAN Homo sapiens 2 0.8197
Aldo-keto reductase family 1 member C3 P42330 AK1C3_HUMAN Homo sapiens 2 0.8197
Endothiapepsin P11838 CARP_CRYPA Cryphonectria parasitica 2 0.8082
Endothiapepsin P11838 CARP_CRYPA Cryphonectria parasitica 2 0.8082
Beta-secretase 1 P56817 BACE1_HUMAN Homo sapiens 2 0.8067
Beta-secretase 1 P56817 BACE1_HUMAN Homo sapiens 2 0.8067
Histone deacetylase-like amidohydrolase Q70I53 HDAH_ALCSD Alcaligenes sp.) 2 0.7850
Histone deacetylase-like amidohydrolase Q70I53 HDAH_ALCSD Alcaligenes sp.) 2 0.7850
Mycocyclosin synthase P9WPP7 CP121_MYCTU Mycobacterium tuberculosis 2 0.7825
Mycocyclosin synthase P9WPP7 CP121_MYCTU Mycobacterium tuberculosis 2 0.7825
ADP-ribosylation factor 1 P84077 ARF1_HUMAN Homo sapiens 2 0.7812
ADP-ribosylation factor 1 P84077 ARF1_HUMAN Homo sapiens 2 0.7812
4,4'-diapophytoene synthase A9JQL9 CRTM_STAAU Staphylococcus aureus 3 0.7803
4,4'-diapophytoene synthase A9JQL9 CRTM_STAAU Staphylococcus aureus 3 0.7803
Methionine aminopeptidase 2 P50579 MAP2_HUMAN Homo sapiens 2 0.7782
Methionine aminopeptidase 2 P50579 MAP2_HUMAN Homo sapiens 2 0.7782
Type IV / VI secretion system DotU domain-containing protein Q9KN50 Q9KN50_VIBCH Vibrio cholerae serotype O1 2 0.7755
Type IV / VI secretion system DotU domain-containing protein Q9KN50 Q9KN50_VIBCH Vibrio cholerae serotype O1 2 0.7755
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 2 0.7719
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 2 0.7719
Hexokinase-4 P35557 HXK4_HUMAN Homo sapiens 2 0.7708
Hexokinase-4 P35557 HXK4_HUMAN Homo sapiens 2 0.7708
Retinoic acid receptor RXR-alpha P19793 RXRA_HUMAN Homo sapiens 2 0.7701
Retinoic acid receptor RXR-alpha P19793 RXRA_HUMAN Homo sapiens 2 0.7701
Glucan 1,3-beta-glucosidase P29717 EXG1_CANAL Candida albicans 2 0.7696
Glucan 1,3-beta-glucosidase P29717 EXG1_CANAL Candida albicans 2 0.7696
Beta-1 adrenergic receptor P07700 ADRB1_MELGA Meleagris gallopavo 2 0.7685
Beta-1 adrenergic receptor P07700 ADRB1_MELGA Meleagris gallopavo 2 0.7685
Histone deacetylase-like amidohydrolase Q70I53 HDAH_ALCSD Alcaligenes sp.) 2 0.7680
Histone deacetylase-like amidohydrolase Q70I53 HDAH_ALCSD Alcaligenes sp.) 2 0.7680
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 2 0.7667
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 2 0.7667
Histone deacetylase 8 Q9BY41 HDAC8_HUMAN Homo sapiens 2 0.7665
Histone deacetylase 8 Q9BY41 HDAC8_HUMAN Homo sapiens 2 0.7665
11-beta-hydroxysteroid dehydrogenase 1 P28845 DHI1_HUMAN Homo sapiens 2 0.7651
11-beta-hydroxysteroid dehydrogenase 1 P28845 DHI1_HUMAN Homo sapiens 2 0.7651
Albumin P02768 ALBU_HUMAN Homo sapiens 2 0.7637
Albumin P02768 ALBU_HUMAN Homo sapiens 2 0.7637
Histone deacetylase 8 Q9BY41 HDAC8_HUMAN Homo sapiens 2 0.7627
Histone deacetylase 8 Q9BY41 HDAC8_HUMAN Homo sapiens 2 0.7627
Glucan 1,3-beta-glucosidase P29717 EXG1_CANAL Candida albicans 2 0.7623
Glucan 1,3-beta-glucosidase P29717 EXG1_CANAL Candida albicans 2 0.7623
cGMP-dependent protein kinase 2 Q13237 KGP2_HUMAN Homo sapiens 2 0.7621
cGMP-dependent protein kinase 2 Q13237 KGP2_HUMAN Homo sapiens 2 0.7621
HTH-type transcriptional regulator EthR P9WMC1 ETHR_MYCTU Mycobacterium tuberculosis 2 0.7597
HTH-type transcriptional regulator EthR P9WMC1 ETHR_MYCTU Mycobacterium tuberculosis 2 0.7597
HTH-type transcriptional regulator EthR P9WMC1 ETHR_MYCTU Mycobacterium tuberculosis 2 0.7589
HTH-type transcriptional regulator EthR P9WMC1 ETHR_MYCTU Mycobacterium tuberculosis 2 0.7589
Peptidyl-prolyl cis-trans isomerase FKBP1A P62942 FKB1A_HUMAN Homo sapiens 2 0.7588
Peptidyl-prolyl cis-trans isomerase FKBP1A P62942 FKB1A_HUMAN Homo sapiens 2 0.7588
Cyclic nucleotide-gated potassium channel mll3241 Q98GN8 CNGK1_RHILO Mesorhizobium japonicum) 2 0.7580
Cyclic nucleotide-gated potassium channel mll3241 Q98GN8 CNGK1_RHILO Mesorhizobium japonicum) 2 0.7580
Cyclic nucleotide-binding domain-containing protein E0RR11 E0RR11_SPITD Spirochaeta thermophila 2 0.7561
Cyclic nucleotide-binding domain-containing protein E0RR11 E0RR11_SPITD Spirochaeta thermophila 2 0.7561
Cytochrome P450 S6BVH1 S6BVH1_RHOER Rhodococcus erythropolis 2 0.7551
Cytochrome P450 S6BVH1 S6BVH1_RHOER Rhodococcus erythropolis 2 0.7551
ATP-dependent molecular chaperone HSP82 P02829 HSP82_YEAST Saccharomyces cerevisiae 2 0.7549
ATP-dependent molecular chaperone HSP82 P02829 HSP82_YEAST Saccharomyces cerevisiae 2 0.7549
ATP synthase subunit alpha, mitochondrial P19483 ATPA_BOVIN Bos taurus 2 0.7544
ATP synthase subunit alpha, mitochondrial P19483 ATPA_BOVIN Bos taurus 2 0.7544
CCA-adding enzyme O28126 CCA_ARCFU Archaeoglobus fulgidus 2 0.7539
Adenylate cyclase 2 A0A2U2H3Y1 A0A384LKY8_YERPE Yersinia pestis 2 0.7539
Adenylate cyclase 2 A0A2U2H3Y1 A0A384LKY8_YERPE Yersinia pestis 2 0.7539
CCA-adding enzyme O28126 CCA_ARCFU Archaeoglobus fulgidus 2 0.7539
cGMP-dependent protein kinase 1 Q13976 KGP1_HUMAN Homo sapiens 2 0.7536
cGMP-dependent protein kinase 1 Q13976 KGP1_HUMAN Homo sapiens 2 0.7536
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 2 0.7530
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 2 0.7530
NADPH-dependent oxidoreductase 2-alkenal reductase Q39172 AER_ARATH Arabidopsis thaliana 2 0.7528
NADPH-dependent oxidoreductase 2-alkenal reductase Q39172 AER_ARATH Arabidopsis thaliana 2 0.7528
Transcriptional activator, LuxR/UhpA family of regulators Q7NQP7 Q7NQP7_CHRVO Chromobacterium violaceum 2 0.7520
Transcriptional activator, LuxR/UhpA family of regulators Q7NQP7 Q7NQP7_CHRVO Chromobacterium violaceum 2 0.7520
Histone deacetylase 8 Q9BY41 HDAC8_HUMAN Homo sapiens 2 0.7519
Histone deacetylase 8 Q9BY41 HDAC8_HUMAN Homo sapiens 2 0.7519
Flavin-dependent monooxygenase Q93L51 TETX_BACT4 Bacteroides thetaiotaomicron 2 0.7502
Flavin-dependent monooxygenase Q93L51 TETX_BACT4 Bacteroides thetaiotaomicron 2 0.7502
Non-receptor tyrosine-protein kinase TYK2 P29597 TYK2_HUMAN Homo sapiens 2 0.7500
Non-receptor tyrosine-protein kinase TYK2 P29597 TYK2_HUMAN Homo sapiens 2 0.7500
3'-5' exoribonuclease Rv2179c P9WJ73 EXRBN_MYCTU Mycobacterium tuberculosis 2 0.7498
3'-5' exoribonuclease Rv2179c P9WJ73 EXRBN_MYCTU Mycobacterium tuberculosis 2 0.7498
Glycogen phosphorylase, muscle form P00489 PYGM_RABIT Oryctolagus cuniculus 2 0.7497
Glycogen phosphorylase, muscle form P00489 PYGM_RABIT Oryctolagus cuniculus 2 0.7497
Non-receptor tyrosine-protein kinase TYK2 P29597 TYK2_HUMAN Homo sapiens 2 0.7491
Non-receptor tyrosine-protein kinase TYK2 P29597 TYK2_HUMAN Homo sapiens 2 0.7491
Genome polyprotein O92972 POLG_HCVJ4 Hepatitis C virus genotype 1b 2 0.7484
Genome polyprotein O92972 POLG_HCVJ4 Hepatitis C virus genotype 1b 2 0.7484
Prenyltransferase Q4R2T2 Q4R2T2_STRC1 Streptomyces sp 2 0.7484
Prenyltransferase Q4R2T2 Q4R2T2_STRC1 Streptomyces sp 2 0.7484
Plasma membrane ATPase Q42932 Q42932_NICPL Nicotiana plumbaginifolia 2 0.7480
Plasma membrane ATPase Q42932 Q42932_NICPL Nicotiana plumbaginifolia 2 0.7480
cAMP-dependent protein kinase type I-alpha regulatory subunit P00514 KAP0_BOVIN Bos taurus 2 0.7474
cAMP-dependent protein kinase type I-alpha regulatory subunit P00514 KAP0_BOVIN Bos taurus 2 0.7474
Succinate dehydrogenase [ubiquinone] flavoprotein subunit, mitochondrial Q0QF01 SDHA_PIG Sus scrofa 2 0.7463
Succinate dehydrogenase [ubiquinone] flavoprotein subunit, mitochondrial Q0QF01 SDHA_PIG Sus scrofa 2 0.7463
Nucleoside diphosphate kinase Q5UQL3 NDK_MIMIV Acanthamoeba polyphaga mimivirus 2 0.7461
Nucleoside diphosphate kinase Q5UQL3 NDK_MIMIV Acanthamoeba polyphaga mimivirus 2 0.7461
Prothrombin P00734 THRB_HUMAN Homo sapiens 2 0.7454
Prothrombin P00734 THRB_HUMAN Homo sapiens 2 0.7454
Protein UshA P07024 USHA_ECOLI Escherichia coli 2 0.7448
Protein UshA P07024 USHA_ECOLI Escherichia coli 2 0.7448
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
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 2 0.7440
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 2 0.7440
Cellular retinoic acid-binding protein 2 P29373 RABP2_HUMAN Homo sapiens 2 0.7436
Cellular retinoic acid-binding protein 2 P29373 RABP2_HUMAN Homo sapiens 2 0.7436
cGMP-dependent protein kinase 1 Q13976 KGP1_HUMAN Homo sapiens 2 0.7431
cGMP-dependent protein kinase 1 Q13976 KGP1_HUMAN Homo sapiens 2 0.7431
Protein claret segregational P20480 NCD_DROME Drosophila melanogaster 2 0.7428
Protein claret segregational P20480 NCD_DROME Drosophila melanogaster 2 0.7428
Macrophage metalloelastase P39900 MMP12_HUMAN Homo sapiens 2 0.7417
Macrophage metalloelastase P39900 MMP12_HUMAN Homo sapiens 2 0.7417
Non-receptor tyrosine-protein kinase TYK2 P29597 TYK2_HUMAN Homo sapiens 2 0.7407
Non-receptor tyrosine-protein kinase TYK2 P29597 TYK2_HUMAN Homo sapiens 2 0.7407
NAD-capped RNA hydrolase NudC P32664 NUDC_ECOLI Escherichia coli 2 0.7406
NAD-capped RNA hydrolase NudC P32664 NUDC_ECOLI Escherichia coli 2 0.7406
Diamine acetyltransferase 1 P21673 SAT1_HUMAN Homo sapiens 2 0.7401
Diamine acetyltransferase 1 P21673 SAT1_HUMAN Homo sapiens 2 0.7401
Valacyclovir hydrolase Q86WA6 BPHL_HUMAN Homo sapiens 2 0.7394
Valacyclovir hydrolase Q86WA6 BPHL_HUMAN Homo sapiens 2 0.7394
Phosphotriesterase Q5KZU5 Q5KZU5_GEOKA Geobacillus kaustophilus 2 0.7385
Phosphotriesterase Q5KZU5 Q5KZU5_GEOKA Geobacillus kaustophilus 2 0.7385
Gag-Pol polyprotein P03369 POL_HV1A2 Human immunodeficiency virus type 1 group M subtype B 2 0.7379
Gag-Pol polyprotein P03369 POL_HV1A2 Human immunodeficiency virus type 1 group M subtype B 2 0.7379
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7378
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7378
cAMP-dependent protein kinase type I-alpha regulatory subunit P00514 KAP0_BOVIN Bos taurus 2 0.7377
cAMP-dependent protein kinase type I-alpha regulatory subunit P00514 KAP0_BOVIN Bos taurus 2 0.7377
Nitric oxide synthase, inducible P29477 NOS2_MOUSE Mus musculus 2 0.7363
Nitric oxide synthase, inducible P29477 NOS2_MOUSE Mus musculus 2 0.7363
Aldo-keto reductase family 1 member C3 P42330 AK1C3_HUMAN Homo sapiens 2 0.7355
Aldo-keto reductase family 1 member C3 P42330 AK1C3_HUMAN Homo sapiens 2 0.7355
Neocarzinostatin P0A3R9 NCZS_STRCZ Streptomyces carzinostaticus 2 0.7353
Purine nucleoside phosphorylase DeoD-type P0ABP8 DEOD_ECOLI Escherichia coli 2 0.7353
Neocarzinostatin P0A3R9 NCZS_STRCZ Streptomyces carzinostaticus 2 0.7353
Purine nucleoside phosphorylase DeoD-type P0ABP8 DEOD_ECOLI Escherichia coli 2 0.7353
Beta-glucosidase 12 B8AVF0 BGL12_ORYSI Oryza sativa subsp. indica 2 0.7349
Beta-glucosidase 12 B8AVF0 BGL12_ORYSI Oryza sativa subsp. indica 2 0.7349
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 2 0.7346
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 2 0.7346
Metallo-beta-lactamase type 2 C7C422 BLAN1_KLEPN Klebsiella pneumoniae 2 0.7346
Metallo-beta-lactamase type 2 C7C422 BLAN1_KLEPN Klebsiella pneumoniae 2 0.7346
Bifunctional epoxide hydrolase 2 P34913 HYES_HUMAN Homo sapiens 2 0.7342
Bifunctional epoxide hydrolase 2 P34913 HYES_HUMAN Homo sapiens 2 0.7342
cAMP-dependent protein kinase type I-alpha regulatory subunit P00514 KAP0_BOVIN Bos taurus 2 0.7340
cAMP-dependent protein kinase type I-alpha regulatory subunit P00514 KAP0_BOVIN Bos taurus 2 0.7340
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.7337
Purine nucleoside phosphorylase P00491 PNPH_HUMAN Homo sapiens 2 0.7337
Purine nucleoside phosphorylase P00491 PNPH_HUMAN Homo sapiens 2 0.7337
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.7337
N-terminal acetyltransferase A complex subunit NAT1 P12945 NAT1_YEAST Saccharomyces cerevisiae 2 0.7335
N-terminal acetyltransferase A complex subunit NAT1 P12945 NAT1_YEAST Saccharomyces cerevisiae 2 0.7335
Purine nucleoside phosphorylase DeoD-type Q5EEL8 DEOD_BACCE Bacillus cereus 2 0.7330
Purine nucleoside phosphorylase DeoD-type Q5EEL8 DEOD_BACCE Bacillus cereus 2 0.7330
ATP synthase subunit alpha, mitochondrial P19483 ATPA_BOVIN Bos taurus 2 0.7321
ATP synthase subunit alpha, mitochondrial P19483 ATPA_BOVIN Bos taurus 2 0.7321
Abscisic acid receptor PYL2 O80992 PYL2_ARATH Arabidopsis thaliana 2 0.7316
Abscisic acid receptor PYL2 O80992 PYL2_ARATH Arabidopsis thaliana 2 0.7316
Aminopeptidase N P15145 AMPN_PIG Sus scrofa 2 0.7305
Aminopeptidase N P15145 AMPN_PIG Sus scrofa 2 0.7305
1-deoxy-D-xylulose 5-phosphate reductoisomerase P45568 DXR_ECOLI Escherichia coli 2 0.7300
1-deoxy-D-xylulose 5-phosphate reductoisomerase P45568 DXR_ECOLI Escherichia coli 2 0.7300
Ribosyldihydronicotinamide dehydrogenase [quinone] P16083 NQO2_HUMAN Homo sapiens 2 0.7297
Ribosyldihydronicotinamide dehydrogenase [quinone] P16083 NQO2_HUMAN Homo sapiens 2 0.7297
Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 Q9Y3Z3 SAMH1_HUMAN Homo sapiens 2 0.7293
Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 Q9Y3Z3 SAMH1_HUMAN Homo sapiens 2 0.7293
Ras-related protein Ral-B P11234 RALB_HUMAN Homo sapiens 2 0.7291
Ras-related protein Ral-B P11234 RALB_HUMAN Homo sapiens 2 0.7291
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 2 0.7290
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 2 0.7290
Cyclic AMP receptor protein Q5SID7 CRP_THET8 Thermus thermophilus 2 0.7284
Cyclic AMP receptor protein Q5SID7 CRP_THET8 Thermus thermophilus 2 0.7284
BMP-2-inducible protein kinase Q9NSY1 BMP2K_HUMAN Homo sapiens 2 0.7276
BMP-2-inducible protein kinase Q9NSY1 BMP2K_HUMAN Homo sapiens 2 0.7276
Beta-1 adrenergic receptor P07700 ADRB1_MELGA Meleagris gallopavo 2 0.7272
Beta-1 adrenergic receptor P07700 ADRB1_MELGA Meleagris gallopavo 2 0.7272
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7257
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7257
Nucleoside 2-deoxyribosyltransferase Q8RLY5 Q8RLY5_LACHE Lactobacillus helveticus 2 0.7256
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7256
Nucleoside 2-deoxyribosyltransferase Q8RLY5 Q8RLY5_LACHE Lactobacillus helveticus 2 0.7256
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7256
Amino-acid acetyltransferase Q5FAK7 Q5FAK7_NEIG1 Neisseria gonorrhoeae 2 0.7253
Amino-acid acetyltransferase Q5FAK7 Q5FAK7_NEIG1 Neisseria gonorrhoeae 2 0.7253
Cyclin-dependent kinase 8 P49336 CDK8_HUMAN Homo sapiens 2 0.7251
Cyclin-dependent kinase 8 P49336 CDK8_HUMAN Homo sapiens 2 0.7251
Metallophosphoesterase A3DJ38 A3DJ38_HUNT2 Clostridium thermocellum 2 0.7250
Metallophosphoesterase A3DJ38 A3DJ38_HUNT2 Clostridium thermocellum 2 0.7250
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 2 0.7248
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 2 0.7248
cAMP-dependent protein kinase type II-beta regulatory subunit P12369 KAP3_RAT Rattus norvegicus 2 0.7247
cAMP-dependent protein kinase type II-beta regulatory subunit P12369 KAP3_RAT Rattus norvegicus 2 0.7247
Methylketone synthase I E0YCS2 E0YCS2_SOLHA Solanum habrochaites 2 0.7244
Methylketone synthase I E0YCS2 E0YCS2_SOLHA Solanum habrochaites 2 0.7244
Carboxypeptidase A1 P00730 CBPA1_BOVIN Bos taurus 2 0.7236
Carboxypeptidase A1 P00730 CBPA1_BOVIN Bos taurus 2 0.7236
Bis(5'-adenosyl)-triphosphatase P49789 FHIT_HUMAN Homo sapiens 2 0.7232
Bis(5'-adenosyl)-triphosphatase P49789 FHIT_HUMAN Homo sapiens 2 0.7232
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7231
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7231
cAMP-dependent protein kinase type II-beta regulatory subunit P12369 KAP3_RAT Rattus norvegicus 2 0.7226
cAMP-dependent protein kinase type II-beta regulatory subunit P12369 KAP3_RAT Rattus norvegicus 2 0.7226
Nitric oxide synthase, inducible P35228 NOS2_HUMAN Homo sapiens 2 0.7223
Nitric oxide synthase, inducible P35228 NOS2_HUMAN Homo sapiens 2 0.7223
Disintegrin and metalloproteinase domain-containing protein 17 P78536 ADA17_HUMAN Homo sapiens 2 0.7218
Disintegrin and metalloproteinase domain-containing protein 17 P78536 ADA17_HUMAN Homo sapiens 2 0.7218
cAMP-dependent protein kinase type I-alpha regulatory subunit P00514 KAP0_BOVIN Bos taurus 2 0.7216
cAMP-dependent protein kinase type I-alpha regulatory subunit P00514 KAP0_BOVIN Bos taurus 2 0.7216
cGMP-dependent protein kinase 1 Q13976 KGP1_HUMAN Homo sapiens 2 0.7210
cGMP-dependent protein kinase 1 Q13976 KGP1_HUMAN Homo sapiens 2 0.7210
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 2 0.7204
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 2 0.7204
Fumarate reductase subunit D P0A8Q3 FRDD_ECOLI Escherichia coli 2 0.7198
Fumarate reductase subunit D P0A8Q3 FRDD_ECOLI Escherichia coli 2 0.7198
S-methyl-5'-thioadenosine phosphorylase I0B503 I0B503_SCHMA Schistosoma mansoni 2 0.7194
S-methyl-5'-thioadenosine phosphorylase I0B503 I0B503_SCHMA Schistosoma mansoni 2 0.7194
Amine oxidase [flavin-containing] B P27338 AOFB_HUMAN Homo sapiens 2 0.7191
Endoplasmin P41148 ENPL_CANLF Canis lupus familiaris 2 0.7191
Amine oxidase [flavin-containing] B P27338 AOFB_HUMAN Homo sapiens 2 0.7191
Endoplasmin P41148 ENPL_CANLF Canis lupus familiaris 2 0.7191
Metallophosphoesterase A3DJ38 A3DJ38_HUNT2 Clostridium thermocellum 2 0.7189
Metallophosphoesterase A3DJ38 A3DJ38_HUNT2 Clostridium thermocellum 2 0.7189
Carnitine O-acetyltransferase P47934 CACP_MOUSE Mus musculus 2 0.7185
Carnitine O-acetyltransferase P47934 CACP_MOUSE Mus musculus 2 0.7185
Liver carboxylesterase 1 P23141 EST1_HUMAN Homo sapiens 2 0.7183
Liver carboxylesterase 1 P23141 EST1_HUMAN Homo sapiens 2 0.7183
Prothrombin P00734 THRB_HUMAN Homo sapiens 2 0.7174
Methionine aminopeptidase 1 P53582 MAP11_HUMAN Homo sapiens 2 0.7174
Prothrombin P00734 THRB_HUMAN Homo sapiens 2 0.7174
Methionine aminopeptidase 1 P53582 MAP11_HUMAN Homo sapiens 2 0.7174
Reaction center protein L chain P0C0Y7 RCEH_RHOSH Rhodobacter sphaeroides 2 0.7170
Reaction center protein L chain P0C0Y7 RCEH_RHOSH Rhodobacter sphaeroides 2 0.7170
Prothrombin P00734 THRB_HUMAN Homo sapiens 2 0.7166
Prothrombin P00734 THRB_HUMAN Homo sapiens 2 0.7166
Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 Q9Y3Z3 SAMH1_HUMAN Homo sapiens 2 0.7166
Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 Q9Y3Z3 SAMH1_HUMAN Homo sapiens 2 0.7166
Cathepsin S P25774 CATS_HUMAN Homo sapiens 2 0.7165
Cathepsin S P25774 CATS_HUMAN Homo sapiens 2 0.7165
RNA polymerase sigma factor SigA Q5SKW1 Q5SKW1_THET8 Thermus thermophilus 2 0.7162
RNA polymerase sigma factor SigA Q5SKW1 Q5SKW1_THET8 Thermus thermophilus 2 0.7162
Purine nucleoside phosphorylase DeoD-type P0ABP9 DEOD_ECO57 Escherichia coli O157:H7 2 0.7161
Purine nucleoside phosphorylase DeoD-type P0ABP9 DEOD_ECO57 Escherichia coli O157:H7 2 0.7161
Hexokinase-4 P35557 HXK4_HUMAN Homo sapiens 2 0.7154
Hexokinase-4 P35557 HXK4_HUMAN Homo sapiens 2 0.7154
Beta-1 adrenergic receptor P07700 ADRB1_MELGA Meleagris gallopavo 2 0.7153
Beta-1 adrenergic receptor P07700 ADRB1_MELGA Meleagris gallopavo 2 0.7153
5-methylthioadenosine/S-adenosylhomocysteine deaminase Q7NZ90 Q7NZ90_CHRVO Chromobacterium violaceum 2 0.7144
5-methylthioadenosine/S-adenosylhomocysteine deaminase Q7NZ90 Q7NZ90_CHRVO Chromobacterium violaceum 2 0.7144
Glycogen synthase kinase-3 beta P49841 GSK3B_HUMAN Homo sapiens 2 0.7141
Glycogen synthase kinase-3 beta P49841 GSK3B_HUMAN Homo sapiens 2 0.7141
Nucleoside diphosphate kinase P15266 NDK_MYXXA Myxococcus xanthus 2 0.7132
Nucleoside diphosphate kinase P15266 NDK_MYXXA Myxococcus xanthus 2 0.7132
Single-stranded-DNA-specific exonuclease RecJ D0EM60 D0EM60_DEIRD Deinococcus radiodurans 2 0.7131
Single-stranded-DNA-specific exonuclease RecJ D0EM60 D0EM60_DEIRD Deinococcus radiodurans 2 0.7131
Phospholipase A2, major isoenzyme P00592 PA21B_PIG Sus scrofa 2 0.7131
Phospholipase A2, major isoenzyme P00592 PA21B_PIG Sus scrofa 2 0.7131
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7130
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7130
Biflaviolin synthase CYP158A1 Q9KZF5 C1581_STRCO Streptomyces coelicolor / M145) 2 0.7130
Biflaviolin synthase CYP158A1 Q9KZF5 C1581_STRCO Streptomyces coelicolor / M145) 2 0.7130
cAMP-dependent protein kinase type I-alpha regulatory subunit P00514 KAP0_BOVIN Bos taurus 2 0.7121
cAMP-dependent protein kinase type I-alpha regulatory subunit P00514 KAP0_BOVIN Bos taurus 2 0.7121
6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 3 Q16875 F263_HUMAN Homo sapiens 2 0.7120
6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 3 Q16875 F263_HUMAN Homo sapiens 2 0.7120
Carbonic anhydrase 4 Q64444 CAH4_MOUSE Mus musculus 2 0.7119
Carbonic anhydrase 4 Q64444 CAH4_MOUSE Mus musculus 2 0.7119
Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2 O88703 HCN2_MOUSE Mus musculus 2 0.7114
Nicotinamide phosphoribosyltransferase P43490 NAMPT_HUMAN Homo sapiens 2 0.7114
Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2 O88703 HCN2_MOUSE Mus musculus 2 0.7114
Nicotinamide phosphoribosyltransferase P43490 NAMPT_HUMAN Homo sapiens 2 0.7114
L-seryl-tRNA(Sec) kinase Q58933 PSTK_METJA Methanocaldococcus jannaschii 2 0.7109
L-seryl-tRNA(Sec) kinase Q58933 PSTK_METJA Methanocaldococcus jannaschii 2 0.7109
Quorum-sensing transcriptional activator Q8XBD0 Q8XBD0_ECO57 Escherichia coli O157:H7 2 0.7106
Quorum-sensing transcriptional activator Q8XBD0 Q8XBD0_ECO57 Escherichia coli O157:H7 2 0.7106
Cytokinin dehydrogenase 1 Q9T0N8 CKX1_MAIZE Zea mays 3 0.7093
Cytokinin dehydrogenase 1 Q9T0N8 CKX1_MAIZE Zea mays 3 0.7093
Ribosyldihydronicotinamide dehydrogenase [quinone] P16083 NQO2_HUMAN Homo sapiens 2 0.7088
Ribosyldihydronicotinamide dehydrogenase [quinone] P16083 NQO2_HUMAN Homo sapiens 2 0.7088
histidine kinase O32393 O32393_ARTPT Arthrospira platensis 2 0.7084
Prothrombin P00734 THRB_HUMAN Homo sapiens 2 0.7084
Prothrombin P00734 THRB_HUMAN Homo sapiens 2 0.7084
histidine kinase O32393 O32393_ARTPT Arthrospira platensis 2 0.7084
Nucleoside diphosphate kinase Q5HFV4 NDK_STAAC Staphylococcus aureus 2 0.7079
Nucleoside diphosphate kinase Q5HFV4 NDK_STAAC Staphylococcus aureus 2 0.7079
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 2 0.7077
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 2 0.7077
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 2 0.7075
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 2 0.7075
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7072
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7072
Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2 O88703 HCN2_MOUSE Mus musculus 2 0.7061
Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2 O88703 HCN2_MOUSE Mus musculus 2 0.7061
Prothrombin P00734 THRB_HUMAN Homo sapiens 2 0.7058
Prothrombin P00734 THRB_HUMAN Homo sapiens 2 0.7058
Prothrombin P00734 THRB_HUMAN Homo sapiens 2 0.7056
Prothrombin P00734 THRB_HUMAN Homo sapiens 2 0.7056
Nucleoside diphosphate kinase A5J299 A5J299_PENVA Penaeus vannamei 2 0.7050
Nucleoside diphosphate kinase A5J299 A5J299_PENVA Penaeus vannamei 2 0.7050
Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 4 Q9Y3Q4 HCN4_HUMAN Homo sapiens 2 0.7047
Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 4 Q9Y3Q4 HCN4_HUMAN Homo sapiens 2 0.7047
Prothrombin P00734 THRB_HUMAN Homo sapiens 2 0.7047
Prothrombin P00734 THRB_HUMAN Homo sapiens 2 0.7047
Polymerase basic protein 2 P31345 PB2_I75A3 Influenza A virus 2 0.7046
Polymerase basic protein 2 P31345 PB2_I75A3 Influenza A virus 2 0.7046
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7045
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7045
Purine nucleoside phosphorylase Q8I3X4 Q8I3X4_PLAF7 Plasmodium falciparum 2 0.7043
Purine nucleoside phosphorylase Q8I3X4 Q8I3X4_PLAF7 Plasmodium falciparum 2 0.7043
Flavin-dependent thymidylate synthase Q9WYT0 THYX_THEMA Thermotoga maritima 2 0.7037
Flavin-dependent thymidylate synthase Q9WYT0 THYX_THEMA Thermotoga maritima 2 0.7037
Phospholipase A2 P00593 PA21B_BOVIN Bos taurus 2 0.7034
Phospholipase A2 P00593 PA21B_BOVIN Bos taurus 2 0.7034
Bifunctional epoxide hydrolase 2 P34913 HYES_HUMAN Homo sapiens 2 0.7031
Bifunctional epoxide hydrolase 2 P34913 HYES_HUMAN Homo sapiens 2 0.7031
Lethal factor P15917 LEF_BACAN Bacillus anthracis 2 0.7026
Lethal factor P15917 LEF_BACAN Bacillus anthracis 2 0.7026
mRNA cleavage and polyadenylation factor CLP1 Q08685 CLP1_YEAST Saccharomyces cerevisiae 2 0.7022
mRNA cleavage and polyadenylation factor CLP1 Q08685 CLP1_YEAST Saccharomyces cerevisiae 2 0.7022
Peptide deformylase 1B, chloroplastic/mitochondrial Q9FUZ2 DEF1B_ARATH Arabidopsis thaliana 2 0.7014
Peptide deformylase 1B, chloroplastic/mitochondrial Q9FUZ2 DEF1B_ARATH Arabidopsis thaliana 2 0.7014
Matrix metalloproteinase-20 O60882 MMP20_HUMAN Homo sapiens 2 0.7012
Matrix metalloproteinase-20 O60882 MMP20_HUMAN Homo sapiens 2 0.7012
Pentaerythritol tetranitrate reductase P71278 P71278_ENTCL Enterobacter cloacae 2 0.7011
Pentaerythritol tetranitrate reductase P71278 P71278_ENTCL Enterobacter cloacae 2 0.7011
Biflaviolin synthase CYP158A2 Q9FCA6 C1582_STRCO Streptomyces coelicolor / M145) 2 0.7009
Biflaviolin synthase CYP158A2 Q9FCA6 C1582_STRCO Streptomyces coelicolor / M145) 2 0.7009
Biflaviolin synthase CYP158A2 Q9FCA6 C1582_STRCO Streptomyces coelicolor / M145) 2 0.7003
Retinoic acid receptor RXR-alpha P19793 RXRA_HUMAN Homo sapiens 2 0.7003
Biflaviolin synthase CYP158A2 Q9FCA6 C1582_STRCO Streptomyces coelicolor / M145) 2 0.7003
Retinoic acid receptor RXR-alpha P19793 RXRA_HUMAN Homo sapiens 2 0.7003
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 2 0.7001
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 2 0.7001
DNA polymerase III subunit epsilon P03007 DPO3E_ECOLI Escherichia coli 2 0.7000
DNA polymerase III subunit epsilon P03007 DPO3E_ECOLI Escherichia coli 2 0.7000

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