Tectorigenin 4'-O-[beta-D-glucopyranosyl-(1'''→6'')-beta-D-glucopyranoside] - Compound Card

Tectorigenin 4'-O-[beta-D-glucopyranosyl-(1'''→6'')-beta-D-glucopyranoside]

Select a section from the left sidebar

Tectorigenin 4'-O-[beta-D-glucopyranosyl-(1'''→6'')-beta-D-glucopyranoside]

Structure
Zoomed Structure
  • Family: Plantae - Iridaceae
  • Kingdom: Plantae
  • Class: Flavonoid
    • Subclass: Isoflavone Glycoside
Canonical Smiles OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3ccc(cc3)c3coc4c(c3=O)c(O)c(c(c4)O)OC)[C@@H]([C@H]([C@@H]2O)O)O)[C@@H]([C@H]([C@@H]1O)O)O
InChI InChI=1S/C28H32O16/c1-39-26-13(30)6-14-17(21(26)34)18(31)12(8-40-14)10-2-4-11(5-3-10)42-28-25(38)23(36)20(33)16(44-28)9-41-27-24(37)22(35)19(32)15(7-29)43-27/h2-6,8,15-16,19-20,22-25,27-30,32-38H,7,9H2,1H3/t15-,16-,19-,20-,22+,23+,24-,25-,27-,28-/m1/s1
InChIKey JUBDCFUPBLXIFI-SKLZQIAYSA-N
Formula C28H32O16
HBA 16
HBD 9
MW 624.55
Rotatable Bonds 8
TPSA 258.43
LogP -2.12
Number Rings 5
Number Aromatic Rings 3
Heavy Atom Count 44
Formal Charge 0
Fraction CSP3 0.46
Exact Mass 624.17
Number of Lipinski Rule Violations 3
# Species Family Kingdom NCBI Taxonomy ID
1 Iris spuria Iridaceae Plantae 93026

Showing of synonyms

  • Farag SF, Kimura Y, et al. (2009). New isoflavone glycosides from Iris spuria L. (Calizona) cultivated in Egypt. Journal of Natural Medicines,2009,63(1),91-95. [View] [PubMed]
Pubchem: 11972472
Nmrshiftdb2: 70031801

No compound-protein relationship available.

Structure

SMILES: O1CCCCC1OCC2CCCC(O2)Oc(cc3)ccc3-c(c4=O)coc(c45)cccc5

Level: 3

Mol. Weight: 624.55 g/mol

Structure

SMILES: c1cccc(c12)occ(c2=O)-c3ccc(cc3)OC4CCCCO4

Level: 2

Mol. Weight: 624.55 g/mol

Structure

SMILES: O1CCCCC1OCC2CCCC(O2)Oc3ccccc3

Level: 2

Mol. Weight: 624.55 g/mol

Structure

SMILES: c1cccc(c12)occ(c2=O)-c3ccccc3

Level: 1

Mol. Weight: 624.55 g/mol

Structure

SMILES: O1CCCCC1COC2CCCCO2

Level: 1

Mol. Weight: 624.55 g/mol

Structure

SMILES: c1ccccc1OC2CCCCO2

Level: 1

Mol. Weight: 624.55 g/mol

Structure

SMILES: c1cccc(c12)occc2=O

Level: 0

Mol. Weight: 624.55 g/mol

Structure

SMILES: C1CCOCC1

Level: 0

Mol. Weight: 624.55 g/mol

Structure

SMILES: c1ccccc1

Level: 0

Mol. Weight: 624.55 g/mol

Antiviral

Absorption

Caco-2 (logPapp)
-6.62
Human Oral Bioavailability 20%
Non-Bioavailable
Human Intestinal Absorption
Non-Absorbed
Madin-Darby Canine Kidney
-5.190
Human Oral Bioavailability 50%
Non-Bioavailable
P-Glycoprotein Inhibitor
Non-Inhibitor
P-Glycoprotein Substrate
Non-Substrate
Skin Permeability
16.11

Distribution

Blood-Brain Barrier (CNS)
-
Blood-Brain Barrier
Non-Penetrable
Fraction Unbound (Human)
0.850
Plasma Protein Binding
74.73
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
Non-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
6.700
Organic Cation Transporter 2
Non-Inhibitor
Half-Life of Drug
-

Toxicity

AMES Mutagenesis
Safe
Avian
Safe
Bee
Toxic
Bioconcentration Factor
-3.330
Biodegradation
Toxic
Carcinogenesis
Safe
Crustacean
Safe
Liver Injury I (DILI)
Safe
Eye Corrosion
Safe
Eye Irritation
Safe
Maximum Tolerated Dose
0.830
Liver Injury II
Toxic
hERG Blockers
Safe
Daphnia Maga
5.260
Micronucleos
Toxic
NR-AhR
Safe
NR-AR
Safe
NR-AR-LBD
Safe
NR-Aromatase
Safe
NR-ER
Safe
NR-ER-LBD
Safe
NR-GR
Safe
NR-PPAR-gamma
Safe
NR-TR
Safe
T. Pyriformis
-27349.320
Rat (Acute)
2.480
Rat (Chronic Oral)
4.340
Fathead Minnow
50.390
Respiratory Disease
Safe
Skin Sensitisation
Safe
SR-ARE
Safe
SR-ATAD5
Safe
SR-HSE
Safe
SR-MMP
Safe
SR-p53
Safe

General Properties

Boiling Point
365.230
Hydration Free Energy
-2.920
Log(D) at pH=7.4
-0.160
Log(P)
-1.02
Log S
-4.58
Log(Vapor Pressure)
-17.13
Melting Point
227.31
pKa Acid
3.55
pKa Basic
5.63
Protein Name UniProt ID Entry Name Species #Pharmacophore Points Probability (0.7 ≤ Tversky Score ≤ 1.0)
Chitinase A Q9AMP1 Q9AMP1_VIBHA Vibrio harveyi 3 0.9719
Chitinase A Q9AMP1 Q9AMP1_VIBHA Vibrio harveyi 3 0.9719
Thymidylate synthase P00469 TYSY_LACCA Lacticaseibacillus casei 3 0.9423
Thymidylate synthase P00469 TYSY_LACCA Lacticaseibacillus casei 3 0.9423
Biflaviolin synthase CYP158A1 Q9KZF5 C1581_STRCO Streptomyces coelicolor / M145) 3 0.9253
Biflaviolin synthase CYP158A1 Q9KZF5 C1581_STRCO Streptomyces coelicolor / M145) 3 0.9253
IOMT 3 Q06YR3 Q06YR3_MEDTR Medicago truncatula 4 0.9225
IOMT 3 Q06YR3 Q06YR3_MEDTR Medicago truncatula 4 0.9225
rRNA N-glycosylase D9J2T9 D9J2T9_MOMBA Momordica balsamina 3 0.9200
rRNA N-glycosylase D9J2T9 D9J2T9_MOMBA Momordica balsamina 3 0.9200
17beta-hydroxysteroid dehydrogenase O93874 O93874_COCLU Cochliobolus lunatus 4 0.9133
17beta-hydroxysteroid dehydrogenase O93874 O93874_COCLU Cochliobolus lunatus 4 0.9133
ATP-dependent molecular chaperone HSP82 P02829 HSP82_YEAST Saccharomyces cerevisiae 3 0.9103
ATP-dependent molecular chaperone HSP82 P02829 HSP82_YEAST Saccharomyces cerevisiae 3 0.9103
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8965
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8965
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8933
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8933
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.8926
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.8926
Nitric oxide synthase oxygenase O34453 NOSO_BACSU Bacillus subtilis 4 0.8914
Nitric oxide synthase oxygenase O34453 NOSO_BACSU Bacillus subtilis 4 0.8914
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.8861
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.8861
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8856
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8856
3'-5' exoribonuclease Rv2179c P9WJ73 EXRBN_MYCTU Mycobacterium tuberculosis 3 0.8825
3'-5' exoribonuclease Rv2179c P9WJ73 EXRBN_MYCTU Mycobacterium tuberculosis 3 0.8825
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.8792
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.8792
Trans-1,2-dihydrobenzene-1,2-diol dehydrogenase Q9TQS6 DHDH_MACFA Macaca fascicularis 3 0.8717
Trans-1,2-dihydrobenzene-1,2-diol dehydrogenase Q9TQS6 DHDH_MACFA Macaca fascicularis 3 0.8717
Hypoxanthine-guanine phosphoribosyltransferase P00492 HPRT_HUMAN Homo sapiens 4 0.8710
Hypoxanthine-guanine phosphoribosyltransferase P00492 HPRT_HUMAN Homo sapiens 4 0.8710
Ribosomal small subunit pseudouridine synthase A P0AA43 RSUA_ECOLI Escherichia coli 3 0.8701
Ribosomal small subunit pseudouridine synthase A P0AA43 RSUA_ECOLI Escherichia coli 3 0.8701
Toxoflavin degrading enzyme E3SET7 E3SET7_PAEPO Paenibacillus polymyxa 3 0.8677
Toxoflavin degrading enzyme E3SET7 E3SET7_PAEPO Paenibacillus polymyxa 3 0.8677
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8605
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8605
Transthyretin P02767 TTHY_RAT Rattus norvegicus 3 0.8604
Transthyretin P02767 TTHY_RAT Rattus norvegicus 3 0.8604
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.8587
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.8587
Sulfide-quinone reductase B7JBP8 SQRD_ACIF2 Acidithiobacillus ferrooxidans) 3 0.8531
Sulfide-quinone reductase B7JBP8 SQRD_ACIF2 Acidithiobacillus ferrooxidans) 3 0.8531
HTH-type transcriptional regulator TtgR Q9AIU0 TTGR_PSEPT Pseudomonas putida 3 0.8492
HTH-type transcriptional regulator TtgR Q9AIU0 TTGR_PSEPT Pseudomonas putida 3 0.8492
Histone deacetylase 4 P56524 HDAC4_HUMAN Homo sapiens 3 0.8460
Histone deacetylase 4 P56524 HDAC4_HUMAN Homo sapiens 3 0.8460
Serine/threonine-protein kinase pim-1 P11309 PIM1_HUMAN Homo sapiens 4 0.8454
Serine/threonine-protein kinase pim-1 P11309 PIM1_HUMAN Homo sapiens 4 0.8454
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8445
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8445
Biflaviolin synthase CYP158A2 Q9FCA6 C1582_STRCO Streptomyces coelicolor / M145) 3 0.8440
Biflaviolin synthase CYP158A2 Q9FCA6 C1582_STRCO Streptomyces coelicolor / M145) 3 0.8440
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8429
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8429
Capsid protein Q9WBP8 Q9WBP8_9VIRU Adeno-associated virus - 1 3 0.8401
Capsid protein Q9WBP8 Q9WBP8_9VIRU Adeno-associated virus - 1 3 0.8401
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.8362
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.8362
Phenylalanine-4-hydroxylase P00439 PH4H_HUMAN Homo sapiens 3 0.8320
Phenylalanine-4-hydroxylase P00439 PH4H_HUMAN Homo sapiens 3 0.8320
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A O76083 PDE9A_HUMAN Homo sapiens 3 0.8293
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A O76083 PDE9A_HUMAN Homo sapiens 3 0.8293
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 4 0.8266
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 4 0.8266
Non-receptor tyrosine-protein kinase TYK2 P29597 TYK2_HUMAN Homo sapiens 4 0.8260
Non-receptor tyrosine-protein kinase TYK2 P29597 TYK2_HUMAN Homo sapiens 4 0.8260
Purine nucleoside phosphorylase P55859 PNPH_BOVIN Bos taurus 4 0.8258
Purine nucleoside phosphorylase P55859 PNPH_BOVIN Bos taurus 4 0.8258
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.8254
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.8254
Biflaviolin synthase CYP158A2 Q9FCA6 C1582_STRCO Streptomyces coelicolor / M145) 3 0.8242
Biflaviolin synthase CYP158A2 Q9FCA6 C1582_STRCO Streptomyces coelicolor / M145) 3 0.8242
Cathepsin S P25774 CATS_HUMAN Homo sapiens 3 0.8240
Cathepsin S P25774 CATS_HUMAN Homo sapiens 3 0.8240
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.8212
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.8212
Pteridine reductase O76290 O76290_TRYBB Trypanosoma brucei brucei 3 0.8204
Pteridine reductase O76290 O76290_TRYBB Trypanosoma brucei brucei 3 0.8204
Reaction center protein L chain P0C0Y7 RCEH_RHOSH Rhodobacter sphaeroides 3 0.8187
Reaction center protein L chain P0C0Y7 RCEH_RHOSH Rhodobacter sphaeroides 3 0.8187
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8181
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8181
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.8139
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.8139
Serine/threonine-protein kinase 24 Q9Y6E0 STK24_HUMAN Homo sapiens 3 0.8136
Serine/threonine-protein kinase 24 Q9Y6E0 STK24_HUMAN Homo sapiens 3 0.8136
cAMP-dependent protein kinase catalytic subunit alpha P00517 KAPCA_BOVIN Bos taurus 3 0.8129
cAMP-dependent protein kinase catalytic subunit alpha P00517 KAPCA_BOVIN Bos taurus 3 0.8129
Bromodomain-containing protein 4 O60885 BRD4_HUMAN Homo sapiens 4 0.8121
Bromodomain-containing protein 4 O60885 BRD4_HUMAN Homo sapiens 4 0.8121
Tyrosine-protein kinase JAK3 P52333 JAK3_HUMAN Homo sapiens 3 0.8091
Tyrosine-protein kinase JAK3 P52333 JAK3_HUMAN Homo sapiens 3 0.8091
Casein kinase II subunit alpha P68400 CSK21_HUMAN Homo sapiens 5 0.8085
Casein kinase II subunit alpha P68400 CSK21_HUMAN Homo sapiens 5 0.8085
Bromodomain-containing protein 4 O60885 BRD4_HUMAN Homo sapiens 4 0.8065
Bromodomain-containing protein 4 O60885 BRD4_HUMAN Homo sapiens 4 0.8065
Transthyretin P02766 TTHY_HUMAN Homo sapiens 4 0.8053
Transthyretin P02766 TTHY_HUMAN Homo sapiens 4 0.8053
Nucleoside permease Q9KPL5 Q9KPL5_VIBCH Vibrio cholerae serotype O1 4 0.8037
Nucleoside permease Q9KPL5 Q9KPL5_VIBCH Vibrio cholerae serotype O1 4 0.8037
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.8021
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.8021
Cytochrome P450 1A1 P04798 CP1A1_HUMAN Homo sapiens 3 0.8010
Cytochrome P450 1A1 P04798 CP1A1_HUMAN Homo sapiens 3 0.8010
Bromodomain-containing protein 2 P25440 BRD2_HUMAN Homo sapiens 3 0.7958
Bromodomain-containing protein 2 P25440 BRD2_HUMAN Homo sapiens 3 0.7958
Purine nucleoside phosphorylase DeoD-type P0ABP8 DEOD_ECOLI Escherichia coli 3 0.7945
Purine nucleoside phosphorylase DeoD-type P0ABP8 DEOD_ECOLI Escherichia coli 3 0.7945
Uracil phosphoribosyltransferase Q26998 UPP_TOXGO Toxoplasma gondii 3 0.7893
Uracil phosphoribosyltransferase Q26998 UPP_TOXGO Toxoplasma gondii 3 0.7893
Purine nucleoside phosphorylase P55859 PNPH_BOVIN Bos taurus 4 0.7884
Purine nucleoside phosphorylase P55859 PNPH_BOVIN Bos taurus 4 0.7884
Serine/threonine-protein kinase 10 O94804 STK10_HUMAN Homo sapiens 3 0.7854
Serine/threonine-protein kinase 10 O94804 STK10_HUMAN Homo sapiens 3 0.7854
Purine nucleoside phosphorylase Q8DTU4 Q8DTU4_STRMU Streptococcus mutans serotype c 4 0.7842
Purine nucleoside phosphorylase Q8DTU4 Q8DTU4_STRMU Streptococcus mutans serotype c 4 0.7842
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7836
beta-glucosidase Q92AS9 Q92AS9_LISIN Listeria innocua serovar 6a 3 0.7836
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7836
beta-glucosidase Q92AS9 Q92AS9_LISIN Listeria innocua serovar 6a 3 0.7836
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 3 0.7834
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 3 0.7834
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A O76083 PDE9A_HUMAN Homo sapiens 3 0.7832
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A O76083 PDE9A_HUMAN Homo sapiens 3 0.7832
Cytidine and deoxycytidylate deaminase zinc-binding region Q82Y41 Q82Y41_NITEU Nitrosomonas europaea 3 0.7811
Cytidine and deoxycytidylate deaminase zinc-binding region Q82Y41 Q82Y41_NITEU Nitrosomonas europaea 3 0.7811
Serine/threonine-protein kinase N1 Q16512 PKN1_HUMAN Homo sapiens 3 0.7765
Serine/threonine-protein kinase N1 Q16512 PKN1_HUMAN Homo sapiens 3 0.7765
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.7742
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.7742
Uracil phosphoribosyltransferase Q26998 UPP_TOXGO Toxoplasma gondii 3 0.7734
Uracil phosphoribosyltransferase Q26998 UPP_TOXGO Toxoplasma gondii 3 0.7734
Hypoxanthine phosphoribosyltransferase Q4DRC4 Q4DRC4_TRYCC Trypanosoma cruzi 3 0.7726
Hypoxanthine phosphoribosyltransferase Q4DRC4 Q4DRC4_TRYCC Trypanosoma cruzi 3 0.7726
Purine nucleoside phosphorylase P55859 PNPH_BOVIN Bos taurus 4 0.7706
Purine nucleoside phosphorylase P55859 PNPH_BOVIN Bos taurus 4 0.7706
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7705
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7705
Genome polyprotein P26663 POLG_HCVBK Hepatitis C virus genotype 1b 3 0.7684
Genome polyprotein P26663 POLG_HCVBK Hepatitis C virus genotype 1b 3 0.7684
Lactotransferrin P24627 TRFL_BOVIN Bos taurus 2 0.7665
Lactotransferrin P24627 TRFL_BOVIN Bos taurus 2 0.7665
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.7664
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.7664
Dihydropteroate synthase Q81VW8 Q81VW8_BACAN Bacillus anthracis 4 0.7661
Dihydropteroate synthase Q81VW8 Q81VW8_BACAN Bacillus anthracis 4 0.7661
Purine nucleoside phosphorylase P00491 PNPH_HUMAN Homo sapiens 4 0.7652
Purine nucleoside phosphorylase P00491 PNPH_HUMAN Homo sapiens 4 0.7652
Purine nucleoside phosphorylase P9WP00 PUNA_MYCTO Mycobacterium tuberculosis 4 0.7623
Purine nucleoside phosphorylase P9WP00 PUNA_MYCTO Mycobacterium tuberculosis 4 0.7623
Polyprotein Q80J95 Q80J95_9CALI Murine norovirus 1 3 0.7618
Polyprotein Q80J95 Q80J95_9CALI Murine norovirus 1 3 0.7618
Odorant-binding protein P81245 OBP_PIG Sus scrofa 3 0.7594
Odorant-binding protein P81245 OBP_PIG Sus scrofa 3 0.7594
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7583
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7583
Deoxycytidine kinase P27707 DCK_HUMAN Homo sapiens 4 0.7582
Deoxycytidine kinase P27707 DCK_HUMAN Homo sapiens 4 0.7582
Chitinase A Q9AMP1 Q9AMP1_VIBHA Vibrio harveyi 2 0.7579
Chitinase A Q9AMP1 Q9AMP1_VIBHA Vibrio harveyi 2 0.7579
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 3 0.7529
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 3 0.7529
Dual specificity mitogen-activated protein kinase kinase 1 Q02750 MP2K1_HUMAN Homo sapiens 3 0.7515
Dual specificity mitogen-activated protein kinase kinase 1 Q02750 MP2K1_HUMAN Homo sapiens 3 0.7515
cAMP-dependent protein kinase catalytic subunit alpha P00517 KAPCA_BOVIN Bos taurus 4 0.7513
cAMP-dependent protein kinase catalytic subunit alpha P00517 KAPCA_BOVIN Bos taurus 4 0.7513
Carbonyl reductase [NADPH] 1 P16152 CBR1_HUMAN Homo sapiens 3 0.7503
Carbonyl reductase [NADPH] 1 P16152 CBR1_HUMAN Homo sapiens 3 0.7503
ActVA 6 protein Q53908 Q53908_STRCH Streptomyces coelicolor 3 0.7499
ActVA 6 protein Q53908 Q53908_STRCH Streptomyces coelicolor 3 0.7499
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.7495
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.7495
[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial Q15119 PDK2_HUMAN Homo sapiens 3 0.7485
[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial Q15119 PDK2_HUMAN Homo sapiens 3 0.7485
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.7481
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.7481
Laminarinase Q9WXN1 Q9WXN1_THEMA Thermotoga maritima 3 0.7463
Laminarinase Q9WXN1 Q9WXN1_THEMA Thermotoga maritima 3 0.7463
Casein kinase II subunit alpha P68400 CSK21_HUMAN Homo sapiens 3 0.7460
Ribulose-1,5 bisphosphate carboxylase/oxygenase large subunit N-methyltransferase, chloroplastic Q43088 RBCMT_PEA Pisum sativum 3 0.7460
Casein kinase II subunit alpha P68400 CSK21_HUMAN Homo sapiens 3 0.7460
Ribulose-1,5 bisphosphate carboxylase/oxygenase large subunit N-methyltransferase, chloroplastic Q43088 RBCMT_PEA Pisum sativum 3 0.7460
NAD(P)H-hydrate epimerase Q8K4Z3 NNRE_MOUSE Mus musculus 3 0.7459
NAD(P)H-hydrate epimerase Q8K4Z3 NNRE_MOUSE Mus musculus 3 0.7459
Ribulose-1,5 bisphosphate carboxylase/oxygenase large subunit N-methyltransferase, chloroplastic Q43088 RBCMT_PEA Pisum sativum 3 0.7434
Ribulose-1,5 bisphosphate carboxylase/oxygenase large subunit N-methyltransferase, chloroplastic Q43088 RBCMT_PEA Pisum sativum 3 0.7434
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 3 0.7431
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 3 0.7431
Chitinase A Q9AMP1 Q9AMP1_VIBHA Vibrio harveyi 2 0.7421
Chitinase A Q9AMP1 Q9AMP1_VIBHA Vibrio harveyi 2 0.7421
Ribulose-1,5 bisphosphate carboxylase/oxygenase large subunit N-methyltransferase, chloroplastic Q43088 RBCMT_PEA Pisum sativum 3 0.7391
Ribulose-1,5 bisphosphate carboxylase/oxygenase large subunit N-methyltransferase, chloroplastic Q43088 RBCMT_PEA Pisum sativum 3 0.7391
Steroid C26-monooxygenase P9WPP1 CP125_MYCTU Mycobacterium tuberculosis 3 0.7381
Steroid C26-monooxygenase P9WPP1 CP125_MYCTU Mycobacterium tuberculosis 3 0.7381
Protein S100-A13 Q99584 S10AD_HUMAN Homo sapiens 3 0.7374
Protein S100-A13 Q99584 S10AD_HUMAN Homo sapiens 3 0.7374
Pheromone-binding protein ASP1 Q9U9J6 Q9U9J6_APIME Apis mellifera 2 0.7358
Pheromone-binding protein ASP1 Q9U9J6 Q9U9J6_APIME Apis mellifera 2 0.7358
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 3 0.7355
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 3 0.7355
Caspase-3 P42574 CASP3_HUMAN Homo sapiens 2 0.7353
Caspase-3 P42574 CASP3_HUMAN Homo sapiens 2 0.7353
Cyclin-dependent kinase 9 P50750 CDK9_HUMAN Homo sapiens 3 0.7347
Cyclin-dependent kinase 9 P50750 CDK9_HUMAN Homo sapiens 3 0.7347
Serine/threonine-protein kinase Chk2 O96017 CHK2_HUMAN Homo sapiens 3 0.7346
Serine/threonine-protein kinase Chk2 O96017 CHK2_HUMAN Homo sapiens 3 0.7346
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.7338
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.7338
S-methyl-5'-thioinosine phosphorylase Q9HZK1 MTIP_PSEAE Pseudomonas aeruginosa 4 0.7337
S-methyl-5'-thioinosine phosphorylase Q9HZK1 MTIP_PSEAE Pseudomonas aeruginosa 4 0.7337
Ephrin type-B receptor 2 P54763 EPHB2_MOUSE Mus musculus 3 0.7327
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.7327
Ephrin type-B receptor 2 P54763 EPHB2_MOUSE Mus musculus 3 0.7327
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.7327
Metallo-beta-lactamase type 2 C7C422 BLAN1_KLEPN Klebsiella pneumoniae 2 0.7289
Metallo-beta-lactamase type 2 C7C422 BLAN1_KLEPN Klebsiella pneumoniae 2 0.7289
Flavoredoxin Q72HI0 Q72HI0_THET2 Thermus thermophilus 3 0.7284
Flavoredoxin Q72HI0 Q72HI0_THET2 Thermus thermophilus 3 0.7284
Aldo-keto reductase family 1 member B1 P15121 ALDR_HUMAN Homo sapiens 3 0.7279
Aldo-keto reductase family 1 member B1 P15121 ALDR_HUMAN Homo sapiens 3 0.7279
Histone-lysine N-methyltransferase SETD7 Q8WTS6 SETD7_HUMAN Homo sapiens 3 0.7275
Histone-lysine N-methyltransferase SETD7 Q8WTS6 SETD7_HUMAN Homo sapiens 3 0.7275
Methionine aminopeptidase P0AE18 MAP1_ECOLI Escherichia coli 3 0.7273
Methionine aminopeptidase P0AE18 MAP1_ECOLI Escherichia coli 3 0.7273
Pancreatic alpha-amylase P04746 AMYP_HUMAN Homo sapiens 2 0.7245
Pancreatic alpha-amylase P04746 AMYP_HUMAN Homo sapiens 2 0.7245
Polymerase acidic protein C3W5S0 C3W5S0_I09A0 Influenza A virus 2 0.7241
Polymerase acidic protein C3W5S0 C3W5S0_I09A0 Influenza A virus 2 0.7241
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 4 0.7221
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 4 0.7221
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7208
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7208
Pteridine reductase 1 Q01782 PTR1_LEIMA Leishmania major 4 0.7206
Pteridine reductase 1 Q01782 PTR1_LEIMA Leishmania major 4 0.7206
C-1-tetrahydrofolate synthase, cytoplasmic P11586 C1TC_HUMAN Homo sapiens 3 0.7189
C-1-tetrahydrofolate synthase, cytoplasmic P11586 C1TC_HUMAN Homo sapiens 3 0.7189
Prothrombin P00734 THRB_HUMAN Homo sapiens 3 0.7185
Prothrombin P00734 THRB_HUMAN Homo sapiens 3 0.7185
cAMP-dependent protein kinase type I-alpha regulatory subunit P00514 KAP0_BOVIN Bos taurus 2 0.7184
cAMP-dependent protein kinase type I-alpha regulatory subunit P00514 KAP0_BOVIN Bos taurus 2 0.7184
Estrogen receptor P03372 ESR1_HUMAN Homo sapiens 4 0.7157
Estrogen receptor P03372 ESR1_HUMAN Homo sapiens 4 0.7157
Dual specificity mitogen-activated protein kinase kinase 1 Q02750 MP2K1_HUMAN Homo sapiens 3 0.7133
Dual specificity mitogen-activated protein kinase kinase 1 Q02750 MP2K1_HUMAN Homo sapiens 3 0.7133
Carbonyl reductase [NADPH] 1 P16152 CBR1_HUMAN Homo sapiens 3 0.7115
Carbonyl reductase [NADPH] 1 P16152 CBR1_HUMAN Homo sapiens 3 0.7115
Bromodomain-containing protein 2 P25440 BRD2_HUMAN Homo sapiens 3 0.7113
Bromodomain-containing protein 2 P25440 BRD2_HUMAN Homo sapiens 3 0.7113
Tyrosine-protein kinase Lck P06239 LCK_HUMAN Homo sapiens 3 0.7093
Tyrosine-protein kinase Lck P06239 LCK_HUMAN Homo sapiens 3 0.7093
Gag-Pol polyprotein P12497 POL_HV1N5 Human immunodeficiency virus type 1 group M subtype B 2 0.7076
Gag-Pol polyprotein P12497 POL_HV1N5 Human immunodeficiency virus type 1 group M subtype B 2 0.7076
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7072
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7072
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.7059
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.7059
CREB-binding protein Q92793 CBP_HUMAN Homo sapiens 3 0.7058
CREB-binding protein Q92793 CBP_HUMAN Homo sapiens 3 0.7058
3-hydroxyanthranilate 3,4-dioxygenase Q1LCS4 3HAO_CUPMC Cupriavidus metallidurans 2 0.7053
3-hydroxyanthranilate 3,4-dioxygenase Q1LCS4 3HAO_CUPMC Cupriavidus metallidurans 2 0.7053
Gag-Pol polyprotein P12497 POL_HV1N5 Human immunodeficiency virus type 1 group M subtype B 2 0.7045
Gag-Pol polyprotein P12497 POL_HV1N5 Human immunodeficiency virus type 1 group M subtype B 2 0.7045
Serine/threonine-protein kinase PLK1 P53350 PLK1_HUMAN Homo sapiens 3 0.7045
Serine/threonine-protein kinase PLK1 P53350 PLK1_HUMAN Homo sapiens 3 0.7045
Thymidine phosphorylase Q7CP66 TYPH_SALTY Salmonella typhimurium 3 0.7039
Thymidine phosphorylase Q7CP66 TYPH_SALTY Salmonella typhimurium 3 0.7039
Purine nucleoside phosphorylase P00491 PNPH_HUMAN Homo sapiens 3 0.7030
Purine nucleoside phosphorylase P00491 PNPH_HUMAN Homo sapiens 3 0.7030
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.7002
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.7002
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7001
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7001

Download SDF