Quercetagetin hexamethyl ether - Compound Card

Quercetagetin hexamethyl ether

Select a section from the left sidebar

Quercetagetin hexamethyl ether

Structure
Zoomed Structure
  • Family: Plantae - Asteraceae
  • Kingdom: Plantae
  • Class: Flavonoid
    • Subclass: Flavonol Aglycone
Canonical Smiles COc1ccc(cc1OC)c1oc2cc(OC)c(c(c2c(=O)c1OC)OC)OC
InChI InChI=1S/C21H22O8/c1-23-12-8-7-11(9-13(12)24-2)18-21(28-6)17(22)16-14(29-18)10-15(25-3)19(26-4)20(16)27-5/h7-10H,1-6H3
InChIKey CHXSDKWBSFDZEU-UHFFFAOYSA-N
Formula C21H22O8
HBA 8
HBD 0
MW 402.4
Rotatable Bonds 7
TPSA 85.59
LogP 3.51
Number Rings 3
Number Aromatic Rings 3
Heavy Atom Count 29
Formal Charge 0
Fraction CSP3 0.29
Exact Mass 402.13
Number of Lipinski Rule Violations 0
# Species Family Kingdom NCBI Taxonomy ID
1 Jasonia montana Asteraceae Plantae 441235
2 Pallenis spinosa Asteraceae Plantae 73981

Showing of synonyms

  • Ahmed AA, Ali AA, et al. (1989). Flavonoids aglycones from Jasonia montana. Phytochemistry,1989,28(2),665-667. [View]
  • Ahmed AA, Spaller M, et al. (1992). Flavonoids of Pallenis spinosa (Asteraceae). Biochemical Systematics and Ecology,1992,20(8),785-786. [View]
CPRiL: 86847
Structure

SMILES: c1cccc(c12)oc(cc2=O)-c3ccccc3

Level: 1

Mol. Weight: 402.4 g/mol

Structure

SMILES: c1cccc(c12)occc2=O

Level: 0

Mol. Weight: 402.4 g/mol

Structure

SMILES: c1ccccc1

Level: 0

Mol. Weight: 402.4 g/mol

No bioactivities available.

Absorption

Caco-2 (logPapp)
-4.56
Human Oral Bioavailability 20%
Bioavailable
Human Intestinal Absorption
Absorbed
Madin-Darby Canine Kidney
-4.680
Human Oral Bioavailability 50%
Bioavailable
P-Glycoprotein Inhibitor
Inhibitor
P-Glycoprotein Substrate
Non-Substrate
Skin Permeability
-1.43

Distribution

Blood-Brain Barrier (CNS)
-
Blood-Brain Barrier
Penetrable
Fraction Unbound (Human)
1.320
Plasma Protein Binding
69.17
Steady State Volume of Distribution
-

Metabolism

Breast Cancer Resistance Protein
Inhibitor
CYP 1A2 Inhibitor
Non-Inhibitor
CYP 1A2 Substrate
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
Non-Substrate
OATP1B1
Non-Inhibitor
OATP1B3
Non-Inhibitor

Excretion

Clearance
4.450
Organic Cation Transporter 2
Non-Inhibitor
Half-Life of Drug
-

Toxicity

AMES Mutagenesis
Safe
Avian
Safe
Bee
Toxic
Bioconcentration Factor
2.090
Biodegradation
Safe
Carcinogenesis
Safe
Crustacean
Toxic
Liver Injury I (DILI)
Safe
Eye Corrosion
Safe
Eye Irritation
Safe
Maximum Tolerated Dose
1.170
Liver Injury II
Toxic
hERG Blockers
Safe
Daphnia Maga
8.320
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
-15.180
Rat (Acute)
2.920
Rat (Chronic Oral)
2.050
Fathead Minnow
5.630
Respiratory Disease
Toxic
Skin Sensitisation
Safe
SR-ARE
Toxic
SR-ATAD5
Toxic
SR-HSE
Safe
SR-MMP
Safe
SR-p53
Safe

General Properties

Boiling Point
468.530
Hydration Free Energy
-7.050
Log(D) at pH=7.4
2.600
Log(P)
2.45
Log S
-3.3
Log(Vapor Pressure)
-7.21
Melting Point
151.55
pKa Acid
8.35
pKa Basic
0.09
Protein Name UniProt ID Entry Name Species #Pharmacophore Points Probability (0.7 ≤ Tversky Score ≤ 1.0)
Chitinase A Q9AMP1 Q9AMP1_VIBHA Vibrio harveyi 3 0.9755
Chitinase A Q9AMP1 Q9AMP1_VIBHA Vibrio harveyi 3 0.9755
Cathepsin S P25774 CATS_HUMAN Homo sapiens 3 0.9574
Cathepsin S P25774 CATS_HUMAN Homo sapiens 3 0.9574
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 3 0.9558
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 3 0.9558
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 3 0.9549
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 3 0.9549
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.9505
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.9505
HTH-type transcriptional regulator TtgR Q9AIU0 TTGR_PSEPT Pseudomonas putida 3 0.9452
HTH-type transcriptional regulator TtgR Q9AIU0 TTGR_PSEPT Pseudomonas putida 3 0.9452
Bromodomain adjacent to zinc finger domain protein 2B Q9UIF8 BAZ2B_HUMAN Homo sapiens 3 0.9421
Bromodomain adjacent to zinc finger domain protein 2B Q9UIF8 BAZ2B_HUMAN Homo sapiens 3 0.9421
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 4 0.9377
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 4 0.9377
ATP synthase subunit alpha, mitochondrial P19483 ATPA_BOVIN Bos taurus 3 0.9375
ATP synthase subunit alpha, mitochondrial P19483 ATPA_BOVIN Bos taurus 3 0.9375
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A Q9Y233 PDE10_HUMAN Homo sapiens 3 0.9170
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A Q9Y233 PDE10_HUMAN Homo sapiens 3 0.9170
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.9159
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.9159
Stromelysin-1 P08254 MMP3_HUMAN Homo sapiens 3 0.9111
Stromelysin-1 P08254 MMP3_HUMAN Homo sapiens 3 0.9111
histidine kinase O32393 O32393_ARTPT Arthrospira platensis 3 0.9085
histidine kinase O32393 O32393_ARTPT Arthrospira platensis 3 0.9085
Tetracycline repressor protein class H P51561 TETR8_PASMD Pasteurella multocida 3 0.9080
Tetracycline repressor protein class H P51561 TETR8_PASMD Pasteurella multocida 3 0.9080
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 5 0.9074
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 5 0.9074
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.9055
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.9055
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.9041
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.9041
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.9030
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.9030
Epidermal growth factor receptor P00533 EGFR_HUMAN Homo sapiens 3 0.8958
Epidermal growth factor receptor P00533 EGFR_HUMAN Homo sapiens 3 0.8958
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.8955
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.8955
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.8939
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.8939
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 5 0.8932
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 5 0.8932
Tyrosine-protein kinase Lck P06239 LCK_HUMAN Homo sapiens 4 0.8924
Tyrosine-protein kinase Lck P06239 LCK_HUMAN Homo sapiens 4 0.8924
Cytochrome P450 1A1 P04798 CP1A1_HUMAN Homo sapiens 3 0.8876
Cytochrome P450 1A1 P04798 CP1A1_HUMAN Homo sapiens 3 0.8876
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.8860
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.8860
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.8832
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.8832
Cathepsin S P25774 CATS_HUMAN Homo sapiens 3 0.8829
Cathepsin S P25774 CATS_HUMAN Homo sapiens 3 0.8829
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 3 0.8799
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 3 0.8799
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.8762
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.8762
Epidermal growth factor receptor P00533 EGFR_HUMAN Homo sapiens 3 0.8734
Epidermal growth factor receptor P00533 EGFR_HUMAN Homo sapiens 3 0.8734
Trans-1,2-dihydrobenzene-1,2-diol dehydrogenase Q9TQS6 DHDH_MACFA Macaca fascicularis 3 0.8677
Trans-1,2-dihydrobenzene-1,2-diol dehydrogenase Q9TQS6 DHDH_MACFA Macaca fascicularis 3 0.8677
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.8607
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.8607
Serine/threonine-protein kinase 24 Q9Y6E0 STK24_HUMAN Homo sapiens 3 0.8595
Serine/threonine-protein kinase 24 Q9Y6E0 STK24_HUMAN Homo sapiens 3 0.8595
Ribosyldihydronicotinamide dehydrogenase [quinone] P16083 NQO2_HUMAN Homo sapiens 4 0.8580
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 3 0.8580
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 3 0.8580
Ribosyldihydronicotinamide dehydrogenase [quinone] P16083 NQO2_HUMAN Homo sapiens 4 0.8580
Serine/threonine-protein kinase 10 O94804 STK10_HUMAN Homo sapiens 3 0.8514
Serine/threonine-protein kinase 10 O94804 STK10_HUMAN Homo sapiens 3 0.8514
Anthocyanidin 3-O-glucosyltransferase UFGT P51094 UFOG_VITVI Vitis vinifera 4 0.8482
Anthocyanidin 3-O-glucosyltransferase UFGT P51094 UFOG_VITVI Vitis vinifera 4 0.8482
Rhodopsin kinase GRK1 P28327 GRK1_BOVIN Bos taurus 3 0.8353
Rhodopsin kinase GRK1 P28327 GRK1_BOVIN Bos taurus 3 0.8353
Cis-2,3-dihydrobiphenyl-2,3-diol dehydrogenase Q46381 BPHB_COMTE Comamonas testosteroni 3 0.8295
Cis-2,3-dihydrobiphenyl-2,3-diol dehydrogenase Q46381 BPHB_COMTE Comamonas testosteroni 3 0.8295
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 3 0.8240
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 3 0.8240
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform O02697 PK3CG_PIG Sus scrofa 4 0.8235
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform O02697 PK3CG_PIG Sus scrofa 4 0.8235
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 3 0.8231
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 3 0.8231
17beta-hydroxysteroid dehydrogenase O93874 O93874_COCLU Cochliobolus lunatus 3 0.8207
17beta-hydroxysteroid dehydrogenase O93874 O93874_COCLU Cochliobolus lunatus 3 0.8207
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 5 0.8206
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 5 0.8206
Epidermal growth factor receptor P00533 EGFR_HUMAN Homo sapiens 3 0.8146
Epidermal growth factor receptor P00533 EGFR_HUMAN Homo sapiens 3 0.8146
Tubulin alpha-1B chain P81947 TBA1B_BOVIN Bos taurus 4 0.8104
Tubulin alpha-1B chain P81947 TBA1B_BOVIN Bos taurus 4 0.8104
HTH-type transcriptional regulator TtgR Q9AIU0 TTGR_PSEPT Pseudomonas putida 3 0.8072
HTH-type transcriptional regulator TtgR Q9AIU0 TTGR_PSEPT Pseudomonas putida 3 0.8072
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 5 0.8038
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 5 0.8038
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform O02697 PK3CG_PIG Sus scrofa 5 0.8036
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform O02697 PK3CG_PIG Sus scrofa 5 0.8036
Anthocyanidin 3-O-glucosyltransferase UFGT P51094 UFOG_VITVI Vitis vinifera 3 0.8032
Anthocyanidin 3-O-glucosyltransferase UFGT P51094 UFOG_VITVI Vitis vinifera 3 0.8032
Epidermal growth factor receptor P00533 EGFR_HUMAN Homo sapiens 3 0.8019
Epidermal growth factor receptor P00533 EGFR_HUMAN Homo sapiens 3 0.8019
Genome polyprotein O92972 POLG_HCVJ4 Hepatitis C virus genotype 1b 3 0.8008
Genome polyprotein O92972 POLG_HCVJ4 Hepatitis C virus genotype 1b 3 0.8008
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 5 0.7998
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 5 0.7998
Phytohormone-binding protein CSBP A0A1S3THR8 PHBP_VIGRR Vigna radiata var. radiata 3 0.7988
Phytohormone-binding protein CSBP A0A1S3THR8 PHBP_VIGRR Vigna radiata var. radiata 3 0.7988
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.7985
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.7985
Epidermal growth factor receptor P00533 EGFR_HUMAN Homo sapiens 3 0.7966
Epidermal growth factor receptor P00533 EGFR_HUMAN Homo sapiens 3 0.7966
cGMP-specific 3',5'-cyclic phosphodiesterase O76074 PDE5A_HUMAN Homo sapiens 3 0.7962
cGMP-specific 3',5'-cyclic phosphodiesterase O76074 PDE5A_HUMAN Homo sapiens 3 0.7962
Peroxisome proliferator-activated receptor gamma P37231 PPARG_HUMAN Homo sapiens 4 0.7923
Peroxisome proliferator-activated receptor gamma P37231 PPARG_HUMAN Homo sapiens 4 0.7923
Mycocyclosin synthase P9WPP7 CP121_MYCTU Mycobacterium tuberculosis 3 0.7897
Mycocyclosin synthase P9WPP7 CP121_MYCTU Mycobacterium tuberculosis 3 0.7897
Fibroblast growth factor receptor 1 P11362 FGFR1_HUMAN Homo sapiens 3 0.7895
Fibroblast growth factor receptor 1 P11362 FGFR1_HUMAN Homo sapiens 3 0.7895
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 3 0.7880
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 3 0.7880
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.7859
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.7859
Protein polybromo-1 Q86U86 PB1_HUMAN Homo sapiens 4 0.7831
Protein polybromo-1 Q86U86 PB1_HUMAN Homo sapiens 4 0.7831
Cyclin-dependent kinase 9 P50750 CDK9_HUMAN Homo sapiens 3 0.7805
Cyclin-dependent kinase 9 P50750 CDK9_HUMAN Homo sapiens 3 0.7805
Genome polyprotein Q2YHF0 POLG_DEN4T Dengue virus type 4 3 0.7777
Genome polyprotein Q2YHF0 POLG_DEN4T Dengue virus type 4 3 0.7777
Gag-Pol polyprotein P12497 POL_HV1N5 Human immunodeficiency virus type 1 group M subtype B 3 0.7769
Gag-Pol polyprotein P12497 POL_HV1N5 Human immunodeficiency virus type 1 group M subtype B 3 0.7769
cGMP-dependent 3',5'-cyclic phosphodiesterase O00408 PDE2A_HUMAN Homo sapiens 3 0.7768
cGMP-dependent 3',5'-cyclic phosphodiesterase O00408 PDE2A_HUMAN Homo sapiens 3 0.7768
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7742
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7742
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.7722
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.7722
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7714
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7714
Casein kinase II subunit alpha P68400 CSK21_HUMAN Homo sapiens 4 0.7675
Casein kinase II subunit alpha P68400 CSK21_HUMAN Homo sapiens 4 0.7675
Lactotransferrin P24627 TRFL_BOVIN Bos taurus 2 0.7644
Lactotransferrin P24627 TRFL_BOVIN Bos taurus 2 0.7644
Prothrombin P00734 THRB_HUMAN Homo sapiens 3 0.7641
Prothrombin P00734 THRB_HUMAN Homo sapiens 3 0.7641
Serine/threonine-protein kinase pim-1 P11309 PIM1_HUMAN Homo sapiens 3 0.7631
Serine/threonine-protein kinase pim-1 P11309 PIM1_HUMAN Homo sapiens 3 0.7631
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 3 0.7630
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 3 0.7630
Histone deacetylase 4 P56524 HDAC4_HUMAN Homo sapiens 2 0.7609
Histone deacetylase 4 P56524 HDAC4_HUMAN Homo sapiens 2 0.7609
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A O76083 PDE9A_HUMAN Homo sapiens 3 0.7600
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A O76083 PDE9A_HUMAN Homo sapiens 3 0.7600
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.7599
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.7599
Thymidylate synthase P0A884 TYSY_ECOLI Escherichia coli 2 0.7598
Thymidylate synthase P0A884 TYSY_ECOLI Escherichia coli 2 0.7598
Biflaviolin synthase CYP158A1 Q9KZF5 C1581_STRCO Streptomyces coelicolor / M145) 3 0.7568
Biflaviolin synthase CYP158A1 Q9KZF5 C1581_STRCO Streptomyces coelicolor / M145) 3 0.7568
Transcriptional regulator, PadR-like family A2RI36 A2RI36_LACLM Lactococcus lactis subsp. cremoris 2 0.7564
Transcriptional regulator, PadR-like family A2RI36 A2RI36_LACLM Lactococcus lactis subsp. cremoris 2 0.7564
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 3 0.7555
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 3 0.7555
Aldo-keto reductase family 1 member B1 P15121 ALDR_HUMAN Homo sapiens 2 0.7541
Aldo-keto reductase family 1 member B1 P15121 ALDR_HUMAN Homo sapiens 2 0.7541
tyrosine--tRNA ligase Q4QFJ7 Q4QFJ7_LEIMA Leishmania major 3 0.7533
tyrosine--tRNA ligase Q4QFJ7 Q4QFJ7_LEIMA Leishmania major 3 0.7533
Phosphatidylinositol 5-phosphate 4-kinase type-2 beta P78356 PI42B_HUMAN Homo sapiens 3 0.7527
Phosphatidylinositol 5-phosphate 4-kinase type-2 beta P78356 PI42B_HUMAN Homo sapiens 3 0.7527
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 3 0.7524
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 3 0.7524
Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase Q05603 COBT_SALTY Salmonella typhimurium 2 0.7518
Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase Q05603 COBT_SALTY Salmonella typhimurium 2 0.7518
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 3 0.7508
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 3 0.7508
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.7496
Succinate dehydrogenase flavoprotein subunit P0AC41 SDHA_ECOLI Escherichia coli 3 0.7496
Succinate dehydrogenase flavoprotein subunit P0AC41 SDHA_ECOLI Escherichia coli 3 0.7496
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.7496
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7493
Riboflavin synthase P0AFU8 RISA_ECOLI Escherichia coli 3 0.7493
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7493
Riboflavin synthase P0AFU8 RISA_ECOLI Escherichia coli 3 0.7493
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.7489
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.7489
Ribosyldihydronicotinamide dehydrogenase [quinone] P16083 NQO2_HUMAN Homo sapiens 3 0.7487
Ribosyldihydronicotinamide dehydrogenase [quinone] P16083 NQO2_HUMAN Homo sapiens 3 0.7487
Chalcone--flavanone isomerase 1 P28012 CFI1_MEDSA Medicago sativa 3 0.7483
Chalcone--flavanone isomerase 1 P28012 CFI1_MEDSA Medicago sativa 3 0.7483
Bromodomain-containing protein 4 O60885 BRD4_HUMAN Homo sapiens 3 0.7479
Bromodomain-containing protein 4 O60885 BRD4_HUMAN Homo sapiens 3 0.7479
Chitinase A Q9AMP1 Q9AMP1_VIBHA Vibrio harveyi 2 0.7473
Chitinase A Q9AMP1 Q9AMP1_VIBHA Vibrio harveyi 2 0.7473
Phosphoenolpyruvate carboxykinase [GTP] P9WIH3 PCKG_MYCTU Mycobacterium tuberculosis 3 0.7454
Phosphoenolpyruvate carboxykinase [GTP] P9WIH3 PCKG_MYCTU Mycobacterium tuberculosis 3 0.7454
Phosphodiesterase Q8WQX9 Q8WQX9_9TRYP Trypanosoma brucei 3 0.7451
Phosphodiesterase Q8WQX9 Q8WQX9_9TRYP Trypanosoma brucei 3 0.7451
Bromodomain-containing protein 2 P25440 BRD2_HUMAN Homo sapiens 3 0.7448
Bromodomain-containing protein 2 P25440 BRD2_HUMAN Homo sapiens 3 0.7448
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.7445
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 4 0.7445
Chalcone synthase 2 P30074 CHS2_MEDSA Medicago sativa 4 0.7441
Chalcone synthase 2 P30074 CHS2_MEDSA Medicago sativa 4 0.7441
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.7389
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.7389
Casein kinase II subunit alpha P68400 CSK21_HUMAN Homo sapiens 3 0.7376
Bromodomain-containing protein 4 O60885 BRD4_HUMAN Homo sapiens 3 0.7376
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 5 0.7376
Casein kinase II subunit alpha P68400 CSK21_HUMAN Homo sapiens 3 0.7376
Bromodomain-containing protein 4 O60885 BRD4_HUMAN Homo sapiens 3 0.7376
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 5 0.7376
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 3 0.7369
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 3 0.7369
Lactoperoxidase A0A452E9Y6 PERL_CAPHI Capra hircus 2 0.7365
Lactoperoxidase A0A452E9Y6 PERL_CAPHI Capra hircus 2 0.7365
Nucleoprotein P33469 NCAP_CVHOC Human coronavirus OC43 3 0.7364
Nucleoprotein P33469 NCAP_CVHOC Human coronavirus OC43 3 0.7364
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7363
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7363
Histidine kinase 4 Q9C5U0 AHK4_ARATH Arabidopsis thaliana 3 0.7361
Histidine kinase 4 Q9C5U0 AHK4_ARATH Arabidopsis thaliana 3 0.7361
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 3 0.7351
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 3 0.7351
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.7347
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.7347
Glycogen synthase kinase-3 beta P49841 GSK3B_HUMAN Homo sapiens 2 0.7336
Glycogen synthase kinase-3 beta P49841 GSK3B_HUMAN Homo sapiens 2 0.7336
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 3 0.7334
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 3 0.7334
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 4 0.7321
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 4 0.7321
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 2 0.7309
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 2 0.7309
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.7308
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.7308
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.7302
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.7302
Proto-oncogene tyrosine-protein kinase Src P00523 SRC_CHICK Gallus gallus 3 0.7295
Proto-oncogene tyrosine-protein kinase Src P00523 SRC_CHICK Gallus gallus 3 0.7295
Serine/threonine-protein kinase 24 Q9Y6E0 STK24_HUMAN Homo sapiens 3 0.7290
Serine/threonine-protein kinase 24 Q9Y6E0 STK24_HUMAN Homo sapiens 3 0.7290
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 3 0.7288
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 3 0.7288
Aldehyde dehydrogenase, mitochondrial P05091 ALDH2_HUMAN Homo sapiens 3 0.7286
Aldehyde dehydrogenase, mitochondrial P05091 ALDH2_HUMAN Homo sapiens 3 0.7286
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7278
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7278
Polymerase acidic protein C3W5S0 C3W5S0_I09A0 Influenza A virus 2 0.7274
Polymerase acidic protein C3W5S0 C3W5S0_I09A0 Influenza A virus 2 0.7274
Phosphoenolpyruvate carboxykinase [GTP] A5TYT6 PCKG_MYCTA Mycobacterium tuberculosis 3 0.7271
Phosphoenolpyruvate carboxykinase [GTP] A5TYT6 PCKG_MYCTA Mycobacterium tuberculosis 3 0.7271
Beta-lactamase Q9L5C8 Q9L5C8_ECOLX Escherichia coli 3 0.7268
Beta-lactamase Q9L5C8 Q9L5C8_ECOLX Escherichia coli 3 0.7268
Glycogen synthase kinase-3 beta P49841 GSK3B_HUMAN Homo sapiens 2 0.7261
Glycogen synthase kinase-3 beta P49841 GSK3B_HUMAN Homo sapiens 2 0.7261
Serine/threonine-protein kinase pim-1 P11309 PIM1_HUMAN Homo sapiens 4 0.7249
Serine/threonine-protein kinase pim-1 P11309 PIM1_HUMAN Homo sapiens 4 0.7249
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.7245
Tetracycline repressor protein class D P0ACT4 TETR4_ECOLX Escherichia coli 3 0.7245
Class B acid phosphatase Q540U1 APHA_SALTM Salmonella typhimurium 2 0.7221
Class B acid phosphatase Q540U1 APHA_SALTM Salmonella typhimurium 2 0.7221
Peroxisome proliferator-activated receptor gamma P37231 PPARG_HUMAN Homo sapiens 2 0.7212
Peroxisome proliferator-activated receptor gamma P37231 PPARG_HUMAN Homo sapiens 2 0.7212
Thymidylate synthase P00469 TYSY_LACCA Lacticaseibacillus casei 3 0.7197
Thymidylate synthase P00469 TYSY_LACCA Lacticaseibacillus casei 3 0.7197
Photosynthetic reaction center cytochrome c subunit P07173 CYCR_BLAVI Blastochloris viridis 2 0.7191
Photosynthetic reaction center cytochrome c subunit P07173 CYCR_BLAVI Blastochloris viridis 2 0.7191
Lethal(3)malignant brain tumor-like protein 1 Q9Y468 LMBL1_HUMAN Homo sapiens 3 0.7184
Lethal(3)malignant brain tumor-like protein 1 Q9Y468 LMBL1_HUMAN Homo sapiens 3 0.7184
Angiotensin-converting enzyme 2 Q9BYF1 ACE2_HUMAN Homo sapiens 2 0.7159
Angiotensin-converting enzyme 2 Q9BYF1 ACE2_HUMAN Homo sapiens 2 0.7159
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 4 0.7151
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 4 0.7151
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform P48736 PK3CG_HUMAN Homo sapiens 3 0.7147
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform P48736 PK3CG_HUMAN Homo sapiens 3 0.7147
Beta-secretase 2 Q9Y5Z0 BACE2_HUMAN Homo sapiens 2 0.7133
Beta-secretase 2 Q9Y5Z0 BACE2_HUMAN Homo sapiens 2 0.7133
Beta-lactamase Q9L5C8 Q9L5C8_ECOLX Escherichia coli 3 0.7132
Beta-lactamase Q9L5C8 Q9L5C8_ECOLX Escherichia coli 3 0.7132
Caspase-3 P42574 CASP3_HUMAN Homo sapiens 2 0.7128
Caspase-3 P42574 CASP3_HUMAN Homo sapiens 2 0.7128
Focal adhesion kinase 1 Q00944 FAK1_CHICK Gallus gallus 3 0.7123
Focal adhesion kinase 1 Q00944 FAK1_CHICK Gallus gallus 3 0.7123
Chitinase A Q9AMP1 Q9AMP1_VIBHA Vibrio harveyi 2 0.7122
Chitinase A Q9AMP1 Q9AMP1_VIBHA Vibrio harveyi 2 0.7122
Aspartokinase 1, chloroplastic Q9LYU8 AK1_ARATH Arabidopsis thaliana 3 0.7114
Aspartokinase 1, chloroplastic Q9LYU8 AK1_ARATH Arabidopsis thaliana 3 0.7114
Aminoglycoside 3'-phosphotransferase AphA1-IAB B0VD92 B0VD92_ACIBY Acinetobacter baumannii 3 0.7109
Aminoglycoside 3'-phosphotransferase AphA1-IAB B0VD92 B0VD92_ACIBY Acinetobacter baumannii 3 0.7109
Glycogen synthase kinase-3 beta P49841 GSK3B_HUMAN Homo sapiens 3 0.7107
Glycogen synthase kinase-3 beta P49841 GSK3B_HUMAN Homo sapiens 3 0.7107
DNA gyrase subunit B Q839Z1 GYRB_ENTFA Enterococcus faecalis 2 0.7102
DNA gyrase subunit B Q839Z1 GYRB_ENTFA Enterococcus faecalis 2 0.7102
Photosynthetic reaction center cytochrome c subunit P07173 CYCR_BLAVI Blastochloris viridis 2 0.7100
Photosynthetic reaction center cytochrome c subunit P07173 CYCR_BLAVI Blastochloris viridis 2 0.7100
Serine/threonine-protein kinase pim-1 P11309 PIM1_HUMAN Homo sapiens 3 0.7095
Serine/threonine-protein kinase pim-1 P11309 PIM1_HUMAN Homo sapiens 3 0.7095
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 3 0.7092
Poly [ADP-ribose] polymerase tankyrase-2 Q9H2K2 TNKS2_HUMAN Homo sapiens 3 0.7092
ActVA 6 protein Q53908 Q53908_STRCH Streptomyces coelicolor 3 0.7091
ActVA 6 protein Q53908 Q53908_STRCH Streptomyces coelicolor 3 0.7091
Neutrophil collagenase P22894 MMP8_HUMAN Homo sapiens 2 0.7077
Neutrophil collagenase P22894 MMP8_HUMAN Homo sapiens 2 0.7077
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 3 0.7067
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 3 0.7067
Tyrosine-protein kinase SYK P43405 KSYK_HUMAN Homo sapiens 2 0.7067
Tyrosine-protein kinase SYK P43405 KSYK_HUMAN Homo sapiens 2 0.7067
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 4 0.7061
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 4 0.7061
Serine/threonine-protein kinase pim-1 P11309 PIM1_HUMAN Homo sapiens 2 0.7058
Serine/threonine-protein kinase pim-1 P11309 PIM1_HUMAN Homo sapiens 2 0.7058
Uncharacterized protein Q3F0V8 Q3F0V8_BACTI Bacillus thuringiensis serovar israelensis ATCC 35646 3 0.7057
Uncharacterized protein Q3F0V8 Q3F0V8_BACTI Bacillus thuringiensis serovar israelensis ATCC 35646 3 0.7057
Pheromone-binding protein ASP1 Q9U9J6 Q9U9J6_APIME Apis mellifera 2 0.7056
Pheromone-binding protein ASP1 Q9U9J6 Q9U9J6_APIME Apis mellifera 2 0.7056
Serine/threonine-protein kinase SKY1 Q03656 SKY1_YEAST Saccharomyces cerevisiae 2 0.7055
Serine/threonine-protein kinase SKY1 Q03656 SKY1_YEAST Saccharomyces cerevisiae 2 0.7055
Acetylcholinesterase P22303 ACES_HUMAN Homo sapiens 3 0.7048
Acetylcholinesterase P22303 ACES_HUMAN Homo sapiens 3 0.7048
Beta-galactoside-specific lectin 4 Q6ITZ3 ML4_VISAL Viscum album 2 0.7047
Beta-galactoside-specific lectin 4 Q6ITZ3 ML4_VISAL Viscum album 2 0.7047
Gag-Pol polyprotein P04584 POL_HV2RO Human immunodeficiency virus type 2 subtype A 3 0.7039
Gag-Pol polyprotein P04584 POL_HV2RO Human immunodeficiency virus type 2 subtype A 3 0.7039
3-phosphoinositide-dependent protein kinase 1 O15530 PDPK1_HUMAN Homo sapiens 3 0.7036
3-phosphoinositide-dependent protein kinase 1 O15530 PDPK1_HUMAN Homo sapiens 3 0.7036
NAD(P)H-hydrate epimerase Q8K4Z3 NNRE_MOUSE Mus musculus 2 0.7024
NAD(P)H-hydrate epimerase Q8K4Z3 NNRE_MOUSE Mus musculus 2 0.7024
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 4 0.7016
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 4 0.7016
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.7013
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.7013
ABC-type polar amino acid transport system, ATPase component Q8RCC2 Q8RCC2_CALS4 Caldanaerobacter subterraneus subsp. tengcongensis 2 0.7012
ABC-type polar amino acid transport system, ATPase component Q8RCC2 Q8RCC2_CALS4 Caldanaerobacter subterraneus subsp. tengcongensis 2 0.7012
Phosphoenolpyruvate carboxykinase [GTP] A5TYT6 PCKG_MYCTA Mycobacterium tuberculosis 3 0.7010
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7010
Phosphoenolpyruvate carboxykinase [GTP] A5TYT6 PCKG_MYCTA Mycobacterium tuberculosis 3 0.7010
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7010
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7005
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 2 0.7005
Fibroblast growth factor receptor 2 P21802 FGFR2_HUMAN Homo sapiens 2 0.7005
Fibroblast growth factor receptor 2 P21802 FGFR2_HUMAN Homo sapiens 2 0.7005

Download SDF