Threo-buddlenol E - Compound Card

Threo-buddlenol E

Select a section from the left sidebar

Threo-buddlenol E

Structure
Zoomed Structure
  • Family: Plantae - Umbelliferae
  • Kingdom: Plantae
  • Class: Lignan
Canonical Smiles COc1cc(cc(c1O[C@H]([C@H](c1ccc(c(c1)OC)O)O)CO)OC)C1OC[C@H]2[C@@H]1CO[C@@H]2c1ccc(c(c1)OC)O
InChI InChI=1S/C31H36O11/c1-36-23-9-16(5-7-21(23)33)28(35)27(13-32)42-31-25(38-3)11-18(12-26(31)39-4)30-20-15-40-29(19(20)14-41-30)17-6-8-22(34)24(10-17)37-2/h5-12,19-20,27-30,32-35H,13-15H2,1-4H3/t19-,20-,27-,28-,29+,30?/m0/s1
InChIKey DVTIDVKFFJRCAB-HWWOLWIBSA-N
Formula C31H36O11
HBA 11
HBD 4
MW 584.62
Rotatable Bonds 11
TPSA 145.53
LogP 3.68
Number Rings 5
Number Aromatic Rings 3
Heavy Atom Count 42
Formal Charge 0
Fraction CSP3 0.42
Exact Mass 584.23
Number of Lipinski Rule Violations 2
# Species Family Kingdom NCBI Taxonomy ID
1 Eryngium triquetrum Umbelliferae Plantae 1094608

Showing of synonyms

  • Bouzergoune F, Ciavatta M.L, et al. (2016). Phytochemical Study of Eryngium triquetrum: Isolation of Polyacetylenes and Lignans. Planta Med,2016,82(16),1438-1445. [View] [PubMed]

No compound-protein relationship available.

Structure

SMILES: c1ccccc1CCOc(cc2)ccc2C3OCC(C34)C(OC4)c5ccccc5

Level: 3

Mol. Weight: 584.62 g/mol

Structure

SMILES: c1ccccc1CCOc(cc2)ccc2C3OCC(C34)COC4

Level: 2

Mol. Weight: 584.62 g/mol

Structure

SMILES: c1ccccc1C(OC2)C(C23)COC3c4ccccc4

Level: 2

Mol. Weight: 584.62 g/mol

Structure

SMILES: c1ccccc1CCOc2ccccc2

Level: 1

Mol. Weight: 584.62 g/mol

Structure

SMILES: C1OCC(C12)COC2c3ccccc3

Level: 1

Mol. Weight: 584.62 g/mol

Structure

SMILES: C1OCC(C12)COC2

Level: 0

Mol. Weight: 584.62 g/mol

Structure

SMILES: c1ccccc1

Level: 0

Mol. Weight: 584.62 g/mol

No bioactivities available.

Absorption

Caco-2 (logPapp)
-5.75
Human Oral Bioavailability 20%
Non-Bioavailable
Human Intestinal Absorption
Non-Absorbed
Madin-Darby Canine Kidney
-4.850
Human Oral Bioavailability 50%
Bioavailable
P-Glycoprotein Inhibitor
Inhibitor
P-Glycoprotein Substrate
Substrate
Skin Permeability
9.14

Distribution

Blood-Brain Barrier (CNS)
-
Blood-Brain Barrier
Non-Penetrable
Fraction Unbound (Human)
0.940
Plasma Protein Binding
74.61
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
Inhibitor
CYP 3A4 Substrate
Substrate
OATP1B1
Inhibitor
OATP1B3
Non-Inhibitor

Excretion

Clearance
14.230
Organic Cation Transporter 2
Inhibitor
Half-Life of Drug
-

Toxicity

AMES Mutagenesis
Safe
Avian
Safe
Bee
Toxic
Bioconcentration Factor
0.860
Biodegradation
Safe
Carcinogenesis
Safe
Crustacean
Safe
Liver Injury I (DILI)
Safe
Eye Corrosion
Safe
Eye Irritation
Safe
Maximum Tolerated Dose
0.410
Liver Injury II
Toxic
hERG Blockers
Safe
Daphnia Maga
7.260
Micronucleos
Toxic
NR-AhR
Safe
NR-AR
Safe
NR-AR-LBD
Safe
NR-Aromatase
Safe
NR-ER
Safe
NR-ER-LBD
Safe
NR-GR
Toxic
NR-PPAR-gamma
Safe
NR-TR
Safe
T. Pyriformis
-19703.590
Rat (Acute)
2.480
Rat (Chronic Oral)
3.570
Fathead Minnow
42.180
Respiratory Disease
Safe
Skin Sensitisation
Safe
SR-ARE
Safe
SR-ATAD5
Safe
SR-HSE
Safe
SR-MMP
Toxic
SR-p53
Safe

General Properties

Boiling Point
375.100
Hydration Free Energy
-2.920
Log(D) at pH=7.4
3.370
Log(P)
1.43
Log S
-4.89
Log(Vapor Pressure)
-11.84
Melting Point
191.17
pKa Acid
7.71
pKa Basic
1.14
Protein Name UniProt ID Entry Name Species #Pharmacophore Points Probability (0.7 ≤ Tversky Score ≤ 1.0)
rRNA N-glycosylase D9J2T9 D9J2T9_MOMBA Momordica balsamina 3 0.9506
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.9393
Flavoredoxin Q72HI0 Q72HI0_THET2 Thermus thermophilus 3 0.9369
Chitinase A Q9AMP1 Q9AMP1_VIBHA Vibrio harveyi 3 0.9351
D-aminoacyl-tRNA deacylase Q8IIS0 DTD_PLAF7 Plasmodium falciparum 3 0.9317
Tannase B3Y018 B3Y018_LACPN Lactiplantibacillus plantarum 4 0.9255
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.9210
MAP kinase-activated protein kinase 2 P49137 MAPK2_HUMAN Homo sapiens 3 0.9208
Lactotransferrin P24627 TRFL_BOVIN Bos taurus 3 0.9178
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.9176
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.9135
DNA gyrase subunit A P0AES5 GYRA_SHIFL Shigella flexneri 3 0.9101
Thymidine phosphorylase Q7CP66 TYPH_SALTY Salmonella typhimurium 3 0.9042
Serine/threonine-protein kinase 24 Q9Y6E0 STK24_HUMAN Homo sapiens 3 0.9010
Serpin domain-containing protein H0ZQY2 H0ZQY2_TAEGU Taeniopygia guttata 3 0.8964
Serine/threonine-protein kinase 10 O94804 STK10_HUMAN Homo sapiens 3 0.8943
Phenylalanine-4-hydroxylase P00439 PH4H_HUMAN Homo sapiens 3 0.8857
Mitogen-activated protein kinase 1 P28482 MK01_HUMAN Homo sapiens 3 0.8852
ALK tyrosine kinase receptor Q9UM73 ALK_HUMAN Homo sapiens 3 0.8842
Stromelysin-1 P08254 MMP3_HUMAN Homo sapiens 3 0.8831
Macrophage metalloelastase P39900 MMP12_HUMAN Homo sapiens 3 0.8811
Uracil phosphoribosyltransferase Q26998 UPP_TOXGO Toxoplasma gondii 3 0.8806
Uracil phosphoribosyltransferase Q26998 UPP_TOXGO Toxoplasma gondii 3 0.8689
Urokinase-type plasminogen activator P00749 UROK_HUMAN Homo sapiens 3 0.8686
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.8675
Beta-secretase 1 P56817 BACE1_HUMAN Homo sapiens 3 0.8670
NADPH-dependent oxidoreductase 2-alkenal reductase Q39172 AER_ARATH Arabidopsis thaliana 3 0.8666
Gag-Pol polyprotein P04584 POL_HV2RO Human immunodeficiency virus type 2 subtype A 4 0.8660
Trans-1,2-dihydrobenzene-1,2-diol dehydrogenase Q9TQS6 DHDH_MACFA Macaca fascicularis 3 0.8615
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.8612
Pantothenate synthetase P9WIL5 PANC_MYCTU Mycobacterium tuberculosis 3 0.8562
Gag-Pol polyprotein P03367 POL_HV1BR Human immunodeficiency virus type 1 group M subtype B 4 0.8555
Urokinase-type plasminogen activator P00749 UROK_HUMAN Homo sapiens 3 0.8554
Nitric oxide synthase oxygenase O34453 NOSO_BACSU Bacillus subtilis 4 0.8513
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.8512
Beta-secretase 1 P56817 BACE1_HUMAN Homo sapiens 3 0.8499
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.8480
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 3 0.8455
Beta-1 adrenergic receptor P07700 ADRB1_MELGA Meleagris gallopavo 4 0.8444
Tetracycline repressor protein class B from transposon Tn10 P04483 TETR2_ECOLX Escherichia coli 3 0.8414
Mycocyclosin synthase P9WPP7 CP121_MYCTU Mycobacterium tuberculosis 3 0.8378
Peptidyl-prolyl cis-trans isomerase FKBP1A P62942 FKB1A_HUMAN Homo sapiens 3 0.8374
Nitric oxide synthase, inducible P29477 NOS2_MOUSE Mus musculus 3 0.8374
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.8345
Pheromone-binding protein ASP1 Q9U9J6 Q9U9J6_APIME Apis mellifera 3 0.8338
cAMP-dependent protein kinase type I-alpha regulatory subunit P00514 KAP0_BOVIN Bos taurus 3 0.8328
Nitric oxide synthase, inducible P29477 NOS2_MOUSE Mus musculus 3 0.8316
ADP-ribosylation factor 1 P84077 ARF1_HUMAN Homo sapiens 2 0.8285
Purine nucleoside phosphorylase P00491 PNPH_HUMAN Homo sapiens 3 0.8279
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.8182
Nuclear receptor subfamily 4immunitygroup A member 1 P22736 NR4A1_HUMAN Homo sapiens 3 0.8174
Peptidyl-prolyl cis-trans isomerase FKBP1A P62942 FKB1A_HUMAN Homo sapiens 3 0.8170
Acetolactate synthase, chloroplastic P17597 ILVB_ARATH Arabidopsis thaliana 3 0.8124
histidine kinase O32393 O32393_ARTPT Arthrospira platensis 3 0.8103
Hypoxanthine phosphoribosyltransferase Q4DRC4 Q4DRC4_TRYCC Trypanosoma cruzi 3 0.8100
11-beta-hydroxysteroid dehydrogenase 1 P28845 DHI1_HUMAN Homo sapiens 3 0.8097
Dual specificity mitogen-activated protein kinase kinase 1 Q02750 MP2K1_HUMAN Homo sapiens 3 0.8093
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.8087
Mycocyclosin synthase P9WPP7 CP121_MYCTU Mycobacterium tuberculosis 3 0.8075
DNA topoisomerase 4 subunit B H7C794 PARE_ENTFA Enterococcus faecalis 3 0.8073
NAD(P)H-hydrate epimerase Q8K4Z3 NNRE_MOUSE Mus musculus 3 0.8060
Macrophage metalloelastase P39900 MMP12_HUMAN Homo sapiens 3 0.8060
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.8057
Proton-gated ion channel Q7NDN8 GLIC_GLOVI Gloeobacter violaceus 3 0.8022
Histone deacetylase 4 P56524 HDAC4_HUMAN Homo sapiens 3 0.8017
Epidermal growth factor receptor P00533 EGFR_HUMAN Homo sapiens 3 0.8007
Acetolactate synthase, chloroplastic P17597 ILVB_ARATH Arabidopsis thaliana 3 0.7992
Thermolysin P00800 THER_BACTH Bacillus thermoproteolyticus 3 0.7951
Cytohesin-2 Q99418 CYH2_HUMAN Homo sapiens 3 0.7946
Purine nucleoside phosphorylase DeoD-type O34925 DEOD_BACSU Bacillus subtilis 3 0.7922
Nicotinamide phosphoribosyltransferase P43490 NAMPT_HUMAN Homo sapiens 3 0.7917
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.7915
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A Q9Y233 PDE10_HUMAN Homo sapiens 3 0.7862
Phosphodiesterase Q8WQX9 Q8WQX9_9TRYP Trypanosoma brucei 4 0.7846
Mycocyclosin synthase P9WPP7 CP121_MYCTU Mycobacterium tuberculosis 3 0.7835
Glycogen synthase kinase-3 beta P49841 GSK3B_HUMAN Homo sapiens 3 0.7830
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 3 0.7799
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 3 0.7795
Type IV / VI secretion system DotU domain-containing protein Q9KN50 Q9KN50_VIBCH Vibrio cholerae serotype O1 3 0.7766
Thymidylate synthase P00469 TYSY_LACCA Lacticaseibacillus casei 3 0.7740
Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase Q05603 COBT_SALTY Salmonella typhimurium 3 0.7731
Dual specificity mitogen-activated protein kinase kinase 1 Q02750 MP2K1_HUMAN Homo sapiens 3 0.7722
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 3 0.7719
Phospholipase A2, major isoenzyme P00592 PA21B_PIG Sus scrofa 3 0.7707
Prothrombin P00734 THRB_HUMAN Homo sapiens 3 0.7703
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.7703
NAD-capped RNA hydrolase NudC P32664 NUDC_ECOLI Escherichia coli 3 0.7700
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A Q9QYJ6 PDE10_RAT Rattus norvegicus 3 0.7697
Genome polyprotein P26663 POLG_HCVBK Hepatitis C virus genotype 1b 3 0.7693
[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial Q15119 PDK2_HUMAN Homo sapiens 3 0.7676
Chalcone--flavanone isomerase 1 P28012 CFI1_MEDSA Medicago sativa 3 0.7657
Tannase B3Y018 B3Y018_LACPN Lactiplantibacillus plantarum 3 0.7650
Tau-tubulin kinase 1 Q5TCY1 TTBK1_HUMAN Homo sapiens 4 0.7632
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.7629
Phosphatidylinositol 5-phosphate 4-kinase type-2 beta P78356 PI42B_HUMAN Homo sapiens 3 0.7616
Capsid protein Q9WBP8 Q9WBP8_9VIRU Adeno-associated virus - 1 3 0.7606
16S rRNA (adenine(1408)-N(1))-methyltransferase A8C927 NPMA_ECOLX Escherichia coli 4 0.7604
Beta-glucuronidase P05804 BGLR_ECOLI Escherichia coli 3 0.7600
Gag-Pol polyprotein P12497 POL_HV1N5 Human immunodeficiency virus type 1 group M subtype B 3 0.7596
IOMT 3 Q06YR3 Q06YR3_MEDTR Medicago truncatula 4 0.7590
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.7588
Lysozyme C II P11941 LYSC2_ONCMY Oncorhynchus mykiss 3 0.7583
HTH-type transcriptional regulator TtgR Q9AIU0 TTGR_PSEPT Pseudomonas putida 3 0.7581
Bifunctional epoxide hydrolase 2 P34913 HYES_HUMAN Homo sapiens 3 0.7575
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 3 0.7570
Genome polyprotein Q2YHF0 POLG_DEN4T Dengue virus type 4 3 0.7563
ALK tyrosine kinase receptor Q9UM73 ALK_HUMAN Homo sapiens 3 0.7552
Ribulose-1,5 bisphosphate carboxylase/oxygenase large subunit N-methyltransferase, chloroplastic Q43088 RBCMT_PEA Pisum sativum 3 0.7543
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.7543
HTH-type transcriptional regulator EthR P9WMC1 ETHR_MYCTU Mycobacterium tuberculosis 3 0.7539
Prothrombin P00734 THRB_HUMAN Homo sapiens 3 0.7535
Dual specificity mitogen-activated protein kinase kinase 1 Q02750 MP2K1_HUMAN Homo sapiens 3 0.7531
Xylose isomerase P24300 XYLA_STRRU Streptomyces rubiginosus 3 0.7526
Ribonuclease J H9CZL7 H9CZL7_DEIRD Deinococcus radiodurans 3 0.7517
Beta-secretase 1 P56817 BACE1_HUMAN Homo sapiens 2 0.7516
Seminal ribonuclease P00669 RNS_BOVIN Bos taurus 3 0.7511
Focal adhesion kinase 1 Q05397 FAK1_HUMAN Homo sapiens 4 0.7510
Beta-galactoside alpha-2,6-sialyltransferase 1 P15907 SIAT1_HUMAN Homo sapiens 4 0.7509
Fibroblast growth factor receptor 1 P11362 FGFR1_HUMAN Homo sapiens 3 0.7509
MAP kinase-activated protein kinase 2 P49137 MAPK2_HUMAN Homo sapiens 4 0.7506
ATP-dependent protease subunit HslV P0A7B8 HSLV_ECOLI Escherichia coli 3 0.7487
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 4 0.7481
Reaction center protein L chain P0C0Y7 RCEH_RHOSH Rhodobacter sphaeroides 3 0.7472
ALK tyrosine kinase receptor Q9UM73 ALK_HUMAN Homo sapiens 3 0.7471
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7470
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7470
Mycocyclosin synthase P9WPP7 CP121_MYCTU Mycobacterium tuberculosis 3 0.7456
Ribulose-1,5 bisphosphate carboxylase/oxygenase large subunit N-methyltransferase, chloroplastic Q43088 RBCMT_PEA Pisum sativum 3 0.7455
Urokinase-type plasminogen activator P00749 UROK_HUMAN Homo sapiens 3 0.7448
Ephrin type-B receptor 4 P54760 EPHB4_HUMAN Homo sapiens 3 0.7441
Vascular endothelial growth factor receptor 2 P35968 VGFR2_HUMAN Homo sapiens 3 0.7438
Uncharacterized protein Q3F0V8 Q3F0V8_BACTI Bacillus thuringiensis serovar israelensis ATCC 35646 3 0.7437
Beta-secretase 1 P56817 BACE1_HUMAN Homo sapiens 3 0.7429
ATP-dependent Clp protease proteolytic subunit P56156 CLPP_HELPY Helicobacter pylori 4 0.7413
Aminopeptidase N P04825 AMPN_ECOLI Escherichia coli 3 0.7412
Ribulose-1,5 bisphosphate carboxylase/oxygenase large subunit N-methyltransferase, chloroplastic Q43088 RBCMT_PEA Pisum sativum 3 0.7410
Disks large homolog 1 Q12959 DLG1_HUMAN Homo sapiens 3 0.7408
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A Q9Y233 PDE10_HUMAN Homo sapiens 3 0.7392
Gag-Pol polyprotein P05896 POL_SIVM1 Simian immunodeficiency virus 3 0.7384
Histone-lysine N-methyltransferase EHMT1 Q9H9B1 EHMT1_HUMAN Homo sapiens 3 0.7381
Purine nucleoside phosphorylase DeoD-type P0ABP9 DEOD_ECO57 Escherichia coli O157:H7 3 0.7378
Matrilysin P09237 MMP7_HUMAN Homo sapiens 3 0.7366
Nitric oxide synthase, inducible P29477 NOS2_MOUSE Mus musculus 3 0.7364
S-adenosylmethionine decarboxylase proenzyme P17707 DCAM_HUMAN Homo sapiens 3 0.7361
2-aminohexano-6-lactam racemase Q7M181 ACLR_ACHOB Achromobacter obae 3 0.7352
Tetracycline repressor protein class H P51561 TETR8_PASMD Pasteurella multocida 3 0.7346
C-1-tetrahydrofolate synthase, cytoplasmic P11586 C1TC_HUMAN Homo sapiens 3 0.7343
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 3 0.7343
Deoxycytidine kinase P27707 DCK_HUMAN Homo sapiens 3 0.7338
Endothiapepsin P11838 CARP_CRYPA Cryphonectria parasitica 3 0.7336
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 3 0.7334
Histone-lysine N-methyltransferase SETD7 Q8WTS6 SETD7_HUMAN Homo sapiens 3 0.7330
Tyrosine-protein kinase SYK P43405 KSYK_HUMAN Homo sapiens 4 0.7322
Abscisic acid receptor PYL1 Q8VZS8 PYL1_ARATH Arabidopsis thaliana 3 0.7316
Beta-lactamase Q79MP6 Q79MP6_PSEAI Pseudomonas aeruginosa 2 0.7314
Histone-lysine N-methyltransferase EHMT1 Q9H9B1 EHMT1_HUMAN Homo sapiens 3 0.7313
Beta-secretase 1 P56817 BACE1_HUMAN Homo sapiens 3 0.7310
Polymerase acidic protein C3W5S0 C3W5S0_I09A0 Influenza A virus 2 0.7310
Tannase B3Y018 B3Y018_LACPN Lactiplantibacillus plantarum 3 0.7308
Gag-Pol polyprotein P03369 POL_HV1A2 Human immunodeficiency virus type 1 group M subtype B 2 0.7308
Pancreatic alpha-amylase P04746 AMYP_HUMAN Homo sapiens 2 0.7308
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7295
Macrophage colony-stimulating factor 1 receptor P07333 CSF1R_HUMAN Homo sapiens 3 0.7292
Mitogen-activated protein kinase 1 P63086 MK01_RAT Rattus norvegicus 3 0.7289
Nucleoside permease Q9KPL5 Q9KPL5_VIBCH Vibrio cholerae serotype O1 4 0.7286
Gag-Pol polyprotein P12497 POL_HV1N5 Human immunodeficiency virus type 1 group M subtype B 2 0.7285
Histone-lysine N-methyltransferase EHMT2 Q96KQ7 EHMT2_HUMAN Homo sapiens 3 0.7279
Purine nucleoside phosphorylase DeoD-type O34925 DEOD_BACSU Bacillus subtilis 2 0.7277
Coagulation factor X P00742 FA10_HUMAN Homo sapiens 3 0.7272
Nitric oxide synthase oxygenase O34453 NOSO_BACSU Bacillus subtilis 4 0.7262
Putative S-adenosyl-L-methionine-dependent methyltransferase ML2640 Q9CCZ4 Y2640_MYCLE Mycobacterium leprae 3 0.7261
Fibroblast growth factor receptor 2 P21802 FGFR2_HUMAN Homo sapiens 3 0.7260
Activin receptor type-1 Q04771 ACVR1_HUMAN Homo sapiens 3 0.7259
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 3 0.7247
Protein mono-ADP-ribosyltransferase PARP3 Q9Y6F1 PARP3_HUMAN Homo sapiens 3 0.7246
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.7245
N-acetyltransferase domain-containing protein Q9HV14 Q9HV14_PSEAE Pseudomonas aeruginosa 3 0.7244
Abscisic acid receptor PYR1 O49686 PYR1_ARATH Arabidopsis thaliana 3 0.7241
Beta-galactoside-specific lectin 4 Q6ITZ3 ML4_VISAL Viscum album 2 0.7240
Gag-Pol polyprotein P12497 POL_HV1N5 Human immunodeficiency virus type 1 group M subtype B 3 0.7237
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 3 0.7234
Kynurenine/alpha-aminoadipate aminotransferase, mitochondrial Q8N5Z0 AADAT_HUMAN Homo sapiens 2 0.7234
Soluble cytochrome b562 P0ABE7 C562_ECOLX Escherichia coli 2 0.7233
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.7225
Endothiapepsin P11838 CARP_CRYPA Cryphonectria parasitica 3 0.7224
Phospholipase A2, major isoenzyme P00592 PA21B_PIG Sus scrofa 3 0.7217
Ephrin type-B receptor 2 P54763 EPHB2_MOUSE Mus musculus 2 0.7215
Anthocyanidin 3-O-glucosyltransferase UFGT P51094 UFOG_VITVI Vitis vinifera 3 0.7214
ATP-dependent molecular chaperone HSP82 P02829 HSP82_YEAST Saccharomyces cerevisiae 2 0.7210
Histone-lysine N-methyltransferase 2A Q03164 KMT2A_HUMAN Homo sapiens 3 0.7207
Histone-lysine N-methyltransferase, H3 lysine-9 specific SUVH4 Q8GZB6 SUVH4_ARATH Arabidopsis thaliana 3 0.7207
Cytidine and deoxycytidylate deaminase zinc-binding region Q82Y41 Q82Y41_NITEU Nitrosomonas europaea 2 0.7207
Homoserine dehydrogenase P31116 DHOM_YEAST Saccharomyces cerevisiae 3 0.7201
Soluble cytochrome b562 P0ABE7 C562_ECOLX Escherichia coli 2 0.7191
Histidine kinase 4 Q9C5U0 AHK4_ARATH Arabidopsis thaliana 3 0.7189
Thymidylate synthase P00469 TYSY_LACCA Lacticaseibacillus casei 3 0.7184
Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase Q05603 COBT_SALTY Salmonella typhimurium 2 0.7182
Uridine phosphorylase P0A1F6 UDP_SALTY Salmonella typhimurium 3 0.7175
Stromelysin-1 P08254 MMP3_HUMAN Homo sapiens 2 0.7169
Histone-lysine N-methyltransferase 2C Q8NEZ4 KMT2C_HUMAN Homo sapiens 3 0.7168
GCN5-related N-acetyltransferase B1YEL6 B1YEL6_EXIS2 Exiguobacterium sibiricum 3 0.7163
Glucan 1,3-beta-glucosidase P29717 EXG1_CANAL Candida albicans 2 0.7160
Nitric oxide synthase, inducible P29477 NOS2_MOUSE Mus musculus 3 0.7157
GCN5-related N-acetyltransferase B1YEL6 B1YEL6_EXIS2 Exiguobacterium sibiricum 3 0.7156
D-alanyl-D-alanine carboxypeptidase P15555 DAC_STRSR Streptomyces sp 2 0.7156
L-lactate dehydrogenase A chain P13491 LDHA_RABIT Oryctolagus cuniculus 2 0.7155
Virulence sensor histidine kinase PhoQ P0DM80 PHOQ_SALTY Salmonella typhimurium 4 0.7152
UDP-galactopyranose mutase Q48485 GLF1_KLEPN Klebsiella pneumoniae 3 0.7148
Phenylalanine-4-hydroxylase P00439 PH4H_HUMAN Homo sapiens 3 0.7122
Endothiapepsin P11838 CARP_CRYPA Cryphonectria parasitica 3 0.7120
Rhodopsin kinase GRK1 P28327 GRK1_BOVIN Bos taurus 3 0.7119
Caffeic acid O-methyltransferase Q9ZTU2 Q9ZTU2_LOLPR Lolium perenne 3 0.7114
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7112
Purine nucleoside phosphorylase DeoD-type Q5EEL8 DEOD_BACCE Bacillus cereus 3 0.7109
Histone-lysine N-methyltransferase EHMT1 Q9H9B1 EHMT1_HUMAN Homo sapiens 3 0.7101
Tyrosine-protein kinase JAK3 P52333 JAK3_HUMAN Homo sapiens 3 0.7101
Methylmalonyl-CoA decarboxylase P52045 SCPB_ECOLI Escherichia coli 3 0.7097
Hypoxanthine-guanine phosphoribosyltransferase P00492 HPRT_HUMAN Homo sapiens 3 0.7097
Serine/threonine-protein kinase SKY1 Q03656 SKY1_YEAST Saccharomyces cerevisiae 2 0.7096
ALK tyrosine kinase receptor Q9UM73 ALK_HUMAN Homo sapiens 3 0.7094
Pteridine reductase 1 Q01782 PTR1_LEIMA Leishmania major 3 0.7094
Hypoxanthine-guanine phosphoribosyltransferase P00492 HPRT_HUMAN Homo sapiens 3 0.7088
Riboflavin biosynthesis protein Q9WZW1 Q9WZW1_THEMA Thermotoga maritima 4 0.7087
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7087
L-lactate dehydrogenase A chain P04642 LDHA_RAT Rattus norvegicus 2 0.7082
[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial Q15119 PDK2_HUMAN Homo sapiens 3 0.7079
3-hydroxybenzoate 4-monooxygenase Q6SSJ6 MOBA_COMTE Comamonas testosteroni 2 0.7075
Probable flavin-dependent thymidylate synthase O41156 THYX_PBCV1 Paramecium bursaria Chlorella virus 1 4 0.7068
Transitional endoplasmic reticulum ATPase P55072 TERA_HUMAN Homo sapiens 3 0.7066
Uncharacterized protein YML079W Q03629 YMH9_YEAST Saccharomyces cerevisiae 2 0.7061
cAMP-dependent protein kinase catalytic subunit alpha P00517 KAPCA_BOVIN Bos taurus 3 0.7060
Nickel-binding periplasmic protein P33590 NIKA_ECOLI Escherichia coli 2 0.7056
Hypoxanthine-guanine phosphoribosyltransferase P00492 HPRT_HUMAN Homo sapiens 3 0.7056
LIM domain kinase 1 P53667 LIMK1_HUMAN Homo sapiens 2 0.7055
dTDP-4-dehydrorhamnose 3,5-epimerase A0A6L7H6N0 A0A1S0QLH9_BACAN Bacillus anthracis 3 0.7054
Proto-oncogene tyrosine-protein kinase Src P00523 SRC_CHICK Gallus gallus 2 0.7049
Albumin P02768 ALBU_HUMAN Homo sapiens 2 0.7044
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7041
Chloramphenicol 3-O phosphotransferase Q56148 CPT_STRVP Streptomyces venezuelae 3 0.7037
rRNA N-glycosylase D9J2T9 D9J2T9_MOMBA Momordica balsamina 4 0.7036
Sulfotransferase 1A1 P50225 ST1A1_HUMAN Homo sapiens 2 0.7036
Fructose-1,6-bisphosphatase 1 P09467 F16P1_HUMAN Homo sapiens 2 0.7033
Endoplasmin P41148 ENPL_CANLF Canis lupus familiaris 3 0.7025
cGMP-dependent 3',5'-cyclic phosphodiesterase O00408 PDE2A_HUMAN Homo sapiens 3 0.7020
Anthranilate phosphoribosyltransferase P00500 TRPD_ACIAD Acinetobacter baylyi 2 0.7019
Biotin carboxylase P24182 ACCC_ECOLI Escherichia coli 4 0.7016
Threonine--tRNA ligase P0A8M3 SYT_ECOLI Escherichia coli 3 0.7008
5-methyltetrahydropteroyltriglutamate--homocysteine methyltransferase 1 O50008 METE1_ARATH Arabidopsis thaliana 2 0.7005
Cyclin-dependent kinase 9 P50750 CDK9_HUMAN Homo sapiens 3 0.7004
Histone-lysine N-methyltransferase EHMT1 Q9H9B1 EHMT1_HUMAN Homo sapiens 3 0.7003
WxcM-like protein Q12KT8 Q12KT8_SHEDO Shewanella denitrificans 3 0.7003

Download SDF