Found 552 hits with Last Name = 'kobayashi' and Initial = 'y' Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Arylacetamide deacetylase
(Homo sapiens (Human)) | BDBM50131270
(2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]prop...)Show SMILES CC(C)C(=O)Nc1ccc(c(c1)C(F)(F)F)[N+]([O-])=O Show InChI InChI=1S/C11H11F3N2O3/c1-6(2)10(17)15-7-3-4-9(16(18)19)8(5-7)11(12,13)14/h3-6H,1-2H3,(H,15,17) | UniProtKB/SwissProt
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| Article
PubMed
| 600 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kanazawa University
Curated by ChEMBL
| Assay Description
Inhibition of AADAC in human kidney microsome |
Drug Metab Dispos 40: 671-9 (2012)
Article DOI: 10.1124/dmd.111.043067
BindingDB Entry DOI: 10.7270/Q2H133RV |
More data for this
Ligand-Target Pair | |
Cocaine esterase
(Homo sapiens (Human)) | BDBM50131270
(2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]prop...)Show SMILES CC(C)C(=O)Nc1ccc(c(c1)C(F)(F)F)[N+]([O-])=O Show InChI InChI=1S/C11H11F3N2O3/c1-6(2)10(17)15-7-3-4-9(16(18)19)8(5-7)11(12,13)14/h3-6H,1-2H3,(H,15,17) | NCI pathway
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| Article
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| 2.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kanazawa University
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant CES2 assessed as compound hydrolysis |
Drug Metab Dispos 40: 1080-4 (2012)
Article DOI: 10.1124/dmd.112.044537
BindingDB Entry DOI: 10.7270/Q2B56MGF |
More data for this
Ligand-Target Pair | |
Arylacetamide deacetylase
(Homo sapiens (Human)) | BDBM50131270
(2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]prop...)Show SMILES CC(C)C(=O)Nc1ccc(c(c1)C(F)(F)F)[N+]([O-])=O Show InChI InChI=1S/C11H11F3N2O3/c1-6(2)10(17)15-7-3-4-9(16(18)19)8(5-7)11(12,13)14/h3-6H,1-2H3,(H,15,17) | UniProtKB/SwissProt
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| 1.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kanazawa University
Curated by ChEMBL
| Assay Description
Inhibition of AADAC in human jejunum microsome |
Drug Metab Dispos 40: 671-9 (2012)
Article DOI: 10.1124/dmd.111.043067
BindingDB Entry DOI: 10.7270/Q2H133RV |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 11
(Homo sapiens (Human)) | BDBM50003019
(8-(Hexahydro-2,5-methano-pentalen-3a-yl)-1,3-dipro...)Show SMILES CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)C12CC3CC1CC(C2)C3 |THB:22:21:18:24.23.25,22:23:18:21.20| Show InChI InChI=1S/C20H28N4O2/c1-3-5-23-16-15(17(25)24(6-4-2)19(23)26)21-18(22-16)20-10-12-7-13(11-20)9-14(20)8-12/h12-14H,3-11H2,1-2H3,(H,21,22) | Reactome pathway
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| 2.07E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagoya University School of Medicine
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of E1S uptake in OAT4-expressing S2 cells |
J Pharmacol Exp Ther 301: 797-802 (2002)
BindingDB Entry DOI: 10.7270/Q2V989BQ |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 11
(Homo sapiens (Human)) | BDBM50003019
(8-(Hexahydro-2,5-methano-pentalen-3a-yl)-1,3-dipro...)Show SMILES CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)C12CC3CC1CC(C2)C3 |THB:22:21:18:24.23.25,22:23:18:21.20| Show InChI InChI=1S/C20H28N4O2/c1-3-5-23-16-15(17(25)24(6-4-2)19(23)26)21-18(22-16)20-10-12-7-13(11-20)9-14(20)8-12/h12-14H,3-11H2,1-2H3,(H,21,22) | Reactome pathway
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| 2.07E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagoya University School of Medicine
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of E1S uptake in OAT4-expressing S2 cells |
J Pharmacol Exp Ther 301: 797-802 (2002)
BindingDB Entry DOI: 10.7270/Q2V989BQ |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 11
(Homo sapiens (Human)) | BDBM50206509
(4-Dipropylsulfamoyl-benzoic acid | 4-Dipropylsulfa...)Show InChI InChI=1S/C13H19NO4S/c1-3-9-14(10-4-2)19(17,18)12-7-5-11(6-8-12)13(15)16/h5-8H,3-4,9-10H2,1-2H3,(H,15,16) | Reactome pathway
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| 4.44E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kyorin University School of Medicine
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of Ochratoxin A uptake in OAT4-expressing S2 cells |
Biochim Biophys Acta 1590: 64-75 (2002)
BindingDB Entry DOI: 10.7270/Q2DZ09JW |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 11
(Homo sapiens (Human)) | BDBM50206509
(4-Dipropylsulfamoyl-benzoic acid | 4-Dipropylsulfa...)Show InChI InChI=1S/C13H19NO4S/c1-3-9-14(10-4-2)19(17,18)12-7-5-11(6-8-12)13(15)16/h5-8H,3-4,9-10H2,1-2H3,(H,15,16) | Reactome pathway
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| 5.49E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagoya University School of Medicine
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of E1S uptake in OAT4-expressing S2 cells |
J Pharmacol Exp Ther 301: 797-802 (2002)
BindingDB Entry DOI: 10.7270/Q2V989BQ |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 11
(Homo sapiens (Human)) | BDBM50206509
(4-Dipropylsulfamoyl-benzoic acid | 4-Dipropylsulfa...)Show InChI InChI=1S/C13H19NO4S/c1-3-9-14(10-4-2)19(17,18)12-7-5-11(6-8-12)13(15)16/h5-8H,3-4,9-10H2,1-2H3,(H,15,16) | Reactome pathway
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| 5.49E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagoya University School of Medicine
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of E1S uptake in OAT4-expressing S2 cells |
J Pharmacol Exp Ther 301: 797-802 (2002)
BindingDB Entry DOI: 10.7270/Q2V989BQ |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 11
(Homo sapiens (Human)) | BDBM85245
(CAS_36322-90-4 | NSC_4856 | Piroxicam)Show SMILES CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O |t:12| Show InChI InChI=1S/C15H13N3O4S/c1-18-13(15(20)17-12-8-4-5-9-16-12)14(19)10-6-2-3-7-11(10)23(18,21)22/h2-9,19H,1H3,(H,16,17,20) | Reactome pathway
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| 1.08E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kyorin University School of Medicine
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of Ochratoxin A uptake in OAT4-expressing S2 cells |
Biochim Biophys Acta 1590: 64-75 (2002)
BindingDB Entry DOI: 10.7270/Q2DZ09JW |
More data for this
Ligand-Target Pair | |
Arylacetamide deacetylase
(Homo sapiens (Human)) | BDBM50370232
(BA-41166E | L-5103 | RIFAMPIN | Rifadin | Rifampic...)Show SMILES CO[C@H]1\C=C\O[C@@]2(C)Oc3c(C2=O)c2c(O)c(\C=N\N4CCN(C)CC4)c(NC(=O)\C(C)=C/C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)c(O)c2c(O)c3C |r,c:33,t:3,35| Show InChI InChI=1S/C43H58N4O12/c1-21-12-11-13-22(2)42(55)45-33-28(20-44-47-17-15-46(9)16-18-47)37(52)30-31(38(33)53)36(51)26(6)40-32(30)41(54)43(8,59-40)57-19-14-29(56-10)23(3)39(58-27(7)48)25(5)35(50)24(4)34(21)49/h11-14,19-21,23-25,29,34-35,39,49-53H,15-18H2,1-10H3,(H,45,55)/b12-11+,19-14+,22-13-,44-20+/t21-,23+,24+,25+,29-,34-,35+,39+,43-/m0/s1 | UniProtKB/SwissProt
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| 2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kanazawa University
Curated by ChEMBL
| Assay Description
Inhibition of AADAC in human liver microsome |
Drug Metab Dispos 40: 671-9 (2012)
Article DOI: 10.1124/dmd.111.043067
BindingDB Entry DOI: 10.7270/Q2H133RV |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 11
(Homo sapiens (Human)) | BDBM23432
(octanoate | octanoate, 1 | octanoic acid | octanoi...)Show InChI InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10)/p-1 | Reactome pathway
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| 2.36E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kyorin University School of Medicine
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of Ochratoxin A uptake in OAT4-expressing S2 cells |
Biochim Biophys Acta 1590: 64-75 (2002)
BindingDB Entry DOI: 10.7270/Q2DZ09JW |
More data for this
Ligand-Target Pair | |
Arylacetamide deacetylase
(Homo sapiens (Human)) | BDBM50370232
(BA-41166E | L-5103 | RIFAMPIN | Rifadin | Rifampic...)Show SMILES CO[C@H]1\C=C\O[C@@]2(C)Oc3c(C2=O)c2c(O)c(\C=N\N4CCN(C)CC4)c(NC(=O)\C(C)=C/C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)c(O)c2c(O)c3C |r,c:33,t:3,35| Show InChI InChI=1S/C43H58N4O12/c1-21-12-11-13-22(2)42(55)45-33-28(20-44-47-17-15-46(9)16-18-47)37(52)30-31(38(33)53)36(51)26(6)40-32(30)41(54)43(8,59-40)57-19-14-29(56-10)23(3)39(58-27(7)48)25(5)35(50)24(4)34(21)49/h11-14,19-21,23-25,29,34-35,39,49-53H,15-18H2,1-10H3,(H,45,55)/b12-11+,19-14+,22-13-,44-20+/t21-,23+,24+,25+,29-,34-,35+,39+,43-/m0/s1 | UniProtKB/SwissProt
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| Article
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| 3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kanazawa University
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant AADAC |
Drug Metab Dispos 40: 671-9 (2012)
Article DOI: 10.1124/dmd.111.043067
BindingDB Entry DOI: 10.7270/Q2H133RV |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 11
(Homo sapiens (Human)) | BDBM50344961
(CHEMBL510139 | citrinin)Show SMILES C[C@H]1OC=C2C(=O)C(C(O)=O)C(=O)C(C)=C2[C@@H]1C |r,c:14,t:3| Show InChI InChI=1S/C13H14O5/c1-5-7(3)18-4-8-9(5)6(2)11(14)10(12(8)15)13(16)17/h4-5,7,10H,1-3H3,(H,16,17)/t5-,7-,10?/m1/s1 | Reactome pathway
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| PubMed
| 3.66E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kyorin University School of Medicine
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of Ochratoxin A uptake in OAT4-expressing S2 cells |
Biochim Biophys Acta 1590: 64-75 (2002)
BindingDB Entry DOI: 10.7270/Q2DZ09JW |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 11
(Homo sapiens (Human)) | BDBM50344964
(Betamipron | CHEMBL1231530 | N-(phenylcarbonyl)-be...)Show InChI InChI=1S/C10H11NO3/c12-9(13)6-7-11-10(14)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,14)(H,12,13) | Reactome pathway
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| 5.02E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagoya University School of Medicine
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of E1S uptake in OAT4-expressing S2 cells |
J Pharmacol Exp Ther 301: 797-802 (2002)
BindingDB Entry DOI: 10.7270/Q2V989BQ |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 11
(Homo sapiens (Human)) | BDBM50344964
(Betamipron | CHEMBL1231530 | N-(phenylcarbonyl)-be...)Show InChI InChI=1S/C10H11NO3/c12-9(13)6-7-11-10(14)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,14)(H,12,13) | Reactome pathway
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| 5.02E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagoya University School of Medicine
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of E1S uptake in OAT4-expressing S2 cells |
J Pharmacol Exp Ther 301: 797-802 (2002)
BindingDB Entry DOI: 10.7270/Q2V989BQ |
More data for this
Ligand-Target Pair | |
Arylacetamide deacetylase
(Homo sapiens (Human)) | BDBM50370232
(BA-41166E | L-5103 | RIFAMPIN | Rifadin | Rifampic...)Show SMILES CO[C@H]1\C=C\O[C@@]2(C)Oc3c(C2=O)c2c(O)c(\C=N\N4CCN(C)CC4)c(NC(=O)\C(C)=C/C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)c(O)c2c(O)c3C |r,c:33,t:3,35| Show InChI InChI=1S/C43H58N4O12/c1-21-12-11-13-22(2)42(55)45-33-28(20-44-47-17-15-46(9)16-18-47)37(52)30-31(38(33)53)36(51)26(6)40-32(30)41(54)43(8,59-40)57-19-14-29(56-10)23(3)39(58-27(7)48)25(5)35(50)24(4)34(21)49/h11-14,19-21,23-25,29,34-35,39,49-53H,15-18H2,1-10H3,(H,45,55)/b12-11+,19-14+,22-13-,44-20+/t21-,23+,24+,25+,29-,34-,35+,39+,43-/m0/s1 | UniProtKB/SwissProt
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| 7.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kanazawa University
Curated by ChEMBL
| Assay Description
Inhibition of AADAC in human jejunum microsome |
Drug Metab Dispos 40: 671-9 (2012)
Article DOI: 10.1124/dmd.111.043067
BindingDB Entry DOI: 10.7270/Q2H133RV |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 7
(Homo sapiens (Human)) | BDBM50206509
(4-Dipropylsulfamoyl-benzoic acid | 4-Dipropylsulfa...)Show InChI InChI=1S/C13H19NO4S/c1-3-9-14(10-4-2)19(17,18)12-7-5-11(6-8-12)13(15)16/h5-8H,3-4,9-10H2,1-2H3,(H,15,16) | Reactome pathway
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| 7.66E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagoya University School of Medicine
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of PGF2alpha uptake in OAT2-expressing S2 cells |
J Pharmacol Exp Ther 301: 797-802 (2002)
BindingDB Entry DOI: 10.7270/Q2V989BQ |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 7
(Homo sapiens (Human)) | BDBM50206509
(4-Dipropylsulfamoyl-benzoic acid | 4-Dipropylsulfa...)Show InChI InChI=1S/C13H19NO4S/c1-3-9-14(10-4-2)19(17,18)12-7-5-11(6-8-12)13(15)16/h5-8H,3-4,9-10H2,1-2H3,(H,15,16) | Reactome pathway
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| 7.66E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagoya University School of Medicine
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of PGF2alpha uptake in OAT2-expressing S2 cells |
J Pharmacol Exp Ther 301: 797-802 (2002)
BindingDB Entry DOI: 10.7270/Q2V989BQ |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162154
(1-[4-(6,7-Dimethoxy-quinolin-4-yloxy)-phenyl]-3-(2...)Show SMILES COc1ccccc1NC(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cc1 Show InChI InChI=1S/C25H23N3O5/c1-30-22-7-5-4-6-19(22)28-25(29)27-16-8-10-17(11-9-16)33-21-12-13-26-20-15-24(32-3)23(31-2)14-18(20)21/h4-15H,1-3H3,(H2,27,28,29) | PDB
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PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 0.200 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162144
(1-(4-Chloro-phenyl)-3-[4-(6,7-dimethoxy-quinolin-4...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccc(Cl)cc4)cc3)c2cc1OC Show InChI InChI=1S/C24H20ClN3O4/c1-30-22-13-19-20(14-23(22)31-2)26-12-11-21(19)32-18-9-7-17(8-10-18)28-24(29)27-16-5-3-15(25)4-6-16/h3-14H,1-2H3,(H2,27,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.200 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162143
(1-[4-(6,7-Dimethoxy-quinolin-4-yloxy)-phenyl]-3-m-...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4cccc(C)c4)cc3)c2cc1OC Show InChI InChI=1S/C25H23N3O4/c1-16-5-4-6-18(13-16)28-25(29)27-17-7-9-19(10-8-17)32-22-11-12-26-21-15-24(31-3)23(30-2)14-20(21)22/h4-15H,1-3H3,(H2,27,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.200 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162167
(1-[4-(6,7-Dimethoxy-quinolin-4-yloxy)-phenyl]-3-ph...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccccc4)cc3)c2cc1OC Show InChI InChI=1S/C24H21N3O4/c1-29-22-14-19-20(15-23(22)30-2)25-13-12-21(19)31-18-10-8-17(9-11-18)27-24(28)26-16-6-4-3-5-7-16/h3-15H,1-2H3,(H2,26,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.200 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162166
(1-[2-Chloro-4-(6,7-dimethoxy-quinolin-4-yloxy)-phe...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccc(F)cc4F)c(Cl)c3)c2cc1OC Show InChI InChI=1S/C24H18ClF2N3O4/c1-32-22-11-15-20(12-23(22)33-2)28-8-7-21(15)34-14-4-6-18(16(25)10-14)29-24(31)30-19-5-3-13(26)9-17(19)27/h3-12H,1-2H3,(H2,29,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.400 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162168
(1-[4-(6,7-Dimethoxy-quinolin-4-yloxy)-phenyl]-3-(4...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc3)c2cc1OC Show InChI InChI=1S/C24H20FN3O4/c1-30-22-13-19-20(14-23(22)31-2)26-12-11-21(19)32-18-9-7-17(8-10-18)28-24(29)27-16-5-3-15(25)4-6-16/h3-14H,1-2H3,(H2,27,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 0.400 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162169
(1-(2,5-Difluoro-phenyl)-3-[4-(6,7-dimethoxy-quinol...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4cc(F)ccc4F)cc3)c2cc1OC Show InChI InChI=1S/C24H19F2N3O4/c1-31-22-12-17-19(13-23(22)32-2)27-10-9-21(17)33-16-6-4-15(5-7-16)28-24(30)29-20-11-14(25)3-8-18(20)26/h3-13H,1-2H3,(H2,28,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.400 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162155
(1-[4-(6,7-Dimethoxy-quinolin-4-yloxy)-phenyl]-3-p-...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccc(C)cc4)cc3)c2cc1OC Show InChI InChI=1S/C25H23N3O4/c1-16-4-6-17(7-5-16)27-25(29)28-18-8-10-19(11-9-18)32-22-12-13-26-21-15-24(31-3)23(30-2)14-20(21)22/h4-15H,1-3H3,(H2,27,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162142
(1-[4-(6,7-Dimethoxy-quinolin-4-yloxy)-phenyl]-3-(2...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccccc4F)cc3)c2cc1OC Show InChI InChI=1S/C24H20FN3O4/c1-30-22-13-17-20(14-23(22)31-2)26-12-11-21(17)32-16-9-7-15(8-10-16)27-24(29)28-19-6-4-3-5-18(19)25/h3-14H,1-2H3,(H2,27,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 0.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162148
(1-(2,4-Difluoro-phenyl)-3-[4-(6,7-dimethoxy-quinol...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccc(F)cc4F)cc3)c2cc1OC Show InChI InChI=1S/C24H19F2N3O4/c1-31-22-12-17-20(13-23(22)32-2)27-10-9-21(17)33-16-6-4-15(5-7-16)28-24(30)29-19-8-3-14(25)11-18(19)26/h3-13H,1-2H3,(H2,28,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.700 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162156
(1-(2,3-Difluoro-phenyl)-3-[4-(6,7-dimethoxy-quinol...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4cccc(F)c4F)cc3)c2cc1OC Show InChI InChI=1S/C24H19F2N3O4/c1-31-21-12-16-19(13-22(21)32-2)27-11-10-20(16)33-15-8-6-14(7-9-15)28-24(30)29-18-5-3-4-17(25)23(18)26/h3-13H,1-2H3,(H2,28,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.700 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162147
(1-(2,4-Difluoro-phenyl)-3-[4-(6,7-dimethoxy-quinol...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccc(F)cc4F)c(F)c3)c2cc1OC Show InChI InChI=1S/C24H18F3N3O4/c1-32-22-11-15-20(12-23(22)33-2)28-8-7-21(15)34-14-4-6-19(17(27)10-14)30-24(31)29-18-5-3-13(25)9-16(18)26/h3-12H,1-2H3,(H2,29,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 0.900 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 in cell-intact assay |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162145
(1-[4-(6,7-Dimethoxy-quinolin-4-yloxy)-phenyl]-3-(3...)Show SMILES COc1cccc(NC(=O)Nc2ccc(Oc3ccnc4cc(OC)c(OC)cc34)cc2)c1 Show InChI InChI=1S/C25H23N3O5/c1-30-19-6-4-5-17(13-19)28-25(29)27-16-7-9-18(10-8-16)33-22-11-12-26-21-15-24(32-3)23(31-2)14-20(21)22/h4-15H,1-3H3,(H2,27,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | <1 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162160
(1-(2,4-Difluoro-phenyl)-3-[4-(6,7-dimethoxy-quinol...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccc(F)cc4F)cc3F)c2cc1OC Show InChI InChI=1S/C24H18F3N3O4/c1-32-22-11-15-19(12-23(22)33-2)28-8-7-20(15)34-21-6-4-14(10-17(21)27)29-24(31)30-18-5-3-13(25)9-16(18)26/h3-12H,1-2H3,(H2,29,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | <1 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162158
(1-[4-(6,7-Dimethoxy-quinolin-4-yloxy)-phenyl]-3-(3...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4cccc(c4)[N+]([O-])=O)cc3)c2cc1OC Show InChI InChI=1S/C24H20N4O6/c1-32-22-13-19-20(14-23(22)33-2)25-11-10-21(19)34-18-8-6-15(7-9-18)26-24(29)27-16-4-3-5-17(12-16)28(30)31/h3-14H,1-2H3,(H2,26,27,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162140
(1-(3,4-Difluoro-phenyl)-3-[4-(6,7-dimethoxy-quinol...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccc(F)c(F)c4)cc3)c2cc1OC Show InChI InChI=1S/C24H19F2N3O4/c1-31-22-12-17-20(13-23(22)32-2)27-10-9-21(17)33-16-6-3-14(4-7-16)28-24(30)29-15-5-8-18(25)19(26)11-15/h3-13H,1-2H3,(H2,28,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162152
(1-[4-(6,7-Dimethoxy-quinolin-4-yloxy)-phenyl]-3-(4...)Show SMILES COc1ccc(NC(=O)Nc2ccc(Oc3ccnc4cc(OC)c(OC)cc34)cc2)cc1 Show InChI InChI=1S/C25H23N3O5/c1-30-18-8-4-16(5-9-18)27-25(29)28-17-6-10-19(11-7-17)33-22-12-13-26-21-15-24(32-3)23(31-2)14-20(21)22/h4-15H,1-3H3,(H2,27,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162162
(1-[4-(6,7-Dimethoxy-quinolin-4-yloxy)-phenyl]-3-(3...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4cccc(F)c4)cc3)c2cc1OC Show InChI InChI=1S/C24H20FN3O4/c1-30-22-13-19-20(14-23(22)31-2)26-11-10-21(19)32-18-8-6-16(7-9-18)27-24(29)28-17-5-3-4-15(25)12-17/h3-14H,1-2H3,(H2,27,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162171
(1-(3-Chloro-phenyl)-3-[4-(6,7-dimethoxy-quinolin-4...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4cccc(Cl)c4)cc3)c2cc1OC Show InChI InChI=1S/C24H20ClN3O4/c1-30-22-13-19-20(14-23(22)31-2)26-11-10-21(19)32-18-8-6-16(7-9-18)27-24(29)28-17-5-3-4-15(25)12-17/h3-14H,1-2H3,(H2,27,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Platelet-derived growth factor receptor alpha
(Homo sapiens (Human)) | BDBM50162156
(1-(2,3-Difluoro-phenyl)-3-[4-(6,7-dimethoxy-quinol...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4cccc(F)c4F)cc3)c2cc1OC Show InChI InChI=1S/C24H19F2N3O4/c1-31-21-12-16-19(13-22(21)32-2)27-11-10-20(16)33-15-8-6-14(7-9-15)28-24(30)29-18-5-3-4-17(25)23(18)26/h3-13H,1-2H3,(H2,28,29,30) | PDB
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PubMed
| n/a | n/a | 1.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of platelet-derived growth factor receptor alpha |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Neuraminidase
(Influenza A virus (A/Puerto Rico/8/34/Mount Sinai(...) | BDBM50219990
(CHEMBL293938)Show SMILES OC(=O)C(F)(F)F.[H][C@@](F)([C@H](O)CO)[C@]1([H])OC(=C[C@H](NC(N)=N)[C@H]1NC(C)=O)C(O)=O |c:16| Show InChI InChI=1S/C12H19FN4O6/c1-4(19)16-9-5(17-12(14)15)2-7(11(21)22)23-10(9)8(13)6(20)3-18/h2,5-6,8-10,18,20H,3H2,1H3,(H,16,19)(H,21,22)(H4,14,15,17)/t5-,6+,8+,9+,10-/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.78 | n/a | n/a | n/a | n/a | n/a | n/a |
Sankyo Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of sialidase activity |
Bioorg Med Chem Lett 12: 1921-4 (2002)
BindingDB Entry DOI: 10.7270/Q2W37ZHP |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162170
(1-(2,6-Difluoro-phenyl)-3-[4-(6,7-dimethoxy-quinol...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4c(F)cccc4F)cc3)c2cc1OC Show InChI InChI=1S/C24H19F2N3O4/c1-31-21-12-16-19(13-22(21)32-2)27-11-10-20(16)33-15-8-6-14(7-9-15)28-24(30)29-23-17(25)4-3-5-18(23)26/h3-13H,1-2H3,(H2,28,29,30) | PDB
MMDB
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Reactome pathway
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PubMed
| n/a | n/a | 1.80 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162163
(1-(3,5-Difluoro-phenyl)-3-[4-(6,7-dimethoxy-quinol...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4cc(F)cc(F)c4)cc3)c2cc1OC Show InChI InChI=1S/C24H19F2N3O4/c1-31-22-12-19-20(13-23(22)32-2)27-8-7-21(19)33-18-5-3-16(4-6-18)28-24(30)29-17-10-14(25)9-15(26)11-17/h3-13H,1-2H3,(H2,28,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
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PubMed
| n/a | n/a | 1.80 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Platelet-derived growth factor receptor alpha
(Homo sapiens (Human)) | BDBM50162145
(1-[4-(6,7-Dimethoxy-quinolin-4-yloxy)-phenyl]-3-(3...)Show SMILES COc1cccc(NC(=O)Nc2ccc(Oc3ccnc4cc(OC)c(OC)cc34)cc2)c1 Show InChI InChI=1S/C25H23N3O5/c1-30-19-6-4-5-17(13-19)28-25(29)27-16-7-9-18(10-8-16)33-22-11-12-26-21-15-24(32-3)23(31-2)14-20(21)22/h4-15H,1-3H3,(H2,27,28,29) | PDB
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| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of platelet-derived growth factor receptor alpha |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Platelet-derived growth factor receptor alpha
(Homo sapiens (Human)) | BDBM50162152
(1-[4-(6,7-Dimethoxy-quinolin-4-yloxy)-phenyl]-3-(4...)Show SMILES COc1ccc(NC(=O)Nc2ccc(Oc3ccnc4cc(OC)c(OC)cc34)cc2)cc1 Show InChI InChI=1S/C25H23N3O5/c1-30-18-8-4-16(5-9-18)27-25(29)28-17-6-10-19(11-7-17)33-22-12-13-26-21-15-24(32-3)23(31-2)14-20(21)22/h4-15H,1-3H3,(H2,27,28,29) | PDB
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| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of platelet-derived growth factor receptor alpha |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162157
(1-[4-(6,7-Dimethoxy-quinazolin-4-yloxy)-phenyl]-3-...)Show SMILES COc1ccc(NC(=O)Nc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)cc1 Show InChI InChI=1S/C24H22N4O5/c1-30-17-8-4-15(5-9-17)27-24(29)28-16-6-10-18(11-7-16)33-23-19-12-21(31-2)22(32-3)13-20(19)25-14-26-23/h4-14H,1-3H3,(H2,27,28,29) | PDB
MMDB
NCI pathway
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UniChem
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PubMed
| n/a | n/a | 2.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162150
(1-[4-(6,7-Dimethoxy-quinolin-4-yloxy)-phenyl]-3-o-...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccccc4C)cc3)c2cc1OC Show InChI InChI=1S/C25H23N3O4/c1-16-6-4-5-7-20(16)28-25(29)27-17-8-10-18(11-9-17)32-22-12-13-26-21-15-24(31-3)23(30-2)14-19(21)22/h4-15H,1-3H3,(H2,27,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
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| CHEMBL
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UniChem
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PubMed
| n/a | n/a | 2.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50162139
(1-[3-Chloro-4-(6,7-dimethoxy-quinolin-4-yloxy)-phe...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccc(F)cc4F)cc3Cl)c2cc1OC Show InChI InChI=1S/C24H18ClF2N3O4/c1-32-22-11-15-19(12-23(22)33-2)28-8-7-20(15)34-21-6-4-14(10-16(21)25)29-24(31)30-18-5-3-13(26)9-17(18)27/h3-12H,1-2H3,(H2,29,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor receptor 2 |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Platelet-derived growth factor receptor alpha
(Homo sapiens (Human)) | BDBM50162166
(1-[2-Chloro-4-(6,7-dimethoxy-quinolin-4-yloxy)-phe...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccc(F)cc4F)c(Cl)c3)c2cc1OC Show InChI InChI=1S/C24H18ClF2N3O4/c1-32-22-11-15-20(12-23(22)33-2)28-8-7-21(15)34-14-4-6-18(16(25)10-14)29-24(31)30-19-5-3-13(26)9-17(19)27/h3-12H,1-2H3,(H2,29,30,31) | PDB
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PubMed
| n/a | n/a | <3 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of platelet-derived growth factor receptor alpha in cell-intact assay |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Platelet-derived growth factor receptor alpha
(Homo sapiens (Human)) | BDBM50162143
(1-[4-(6,7-Dimethoxy-quinolin-4-yloxy)-phenyl]-3-m-...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4cccc(C)c4)cc3)c2cc1OC Show InChI InChI=1S/C25H23N3O4/c1-16-5-4-6-18(13-16)28-25(29)27-17-7-9-19(10-8-17)32-22-11-12-26-21-15-24(31-3)23(30-2)14-20(21)22/h4-15H,1-3H3,(H2,27,28,29) | PDB
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PubMed
| n/a | n/a | 3.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of platelet-derived growth factor receptor alpha |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
Neuraminidase
(Influenza A virus (A/Puerto Rico/8/34/Mount Sinai(...) | BDBM50219984
(CHEMBL299915)Show SMILES OC(=O)C(F)(F)F.[H][C@@](N=[N+]=[N-])([C@H](O)CO)[C@]1([H])OC(=C[C@H](NC(N)=N)[C@H]1NC(C)=O)C(O)=O |c:18| Show InChI InChI=1S/C12H19N7O6/c1-4(21)16-8-5(17-12(13)14)2-7(11(23)24)25-10(8)9(18-19-15)6(22)3-20/h2,5-6,8-10,20,22H,3H2,1H3,(H,16,21)(H,23,24)(H4,13,14,17)/t5-,6+,8+,9+,10+/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.39 | n/a | n/a | n/a | n/a | n/a | n/a |
Sankyo Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of sialidase activity |
Bioorg Med Chem Lett 12: 1921-4 (2002)
BindingDB Entry DOI: 10.7270/Q2W37ZHP |
More data for this
Ligand-Target Pair | |
Platelet-derived growth factor receptor alpha
(Homo sapiens (Human)) | BDBM50162148
(1-(2,4-Difluoro-phenyl)-3-[4-(6,7-dimethoxy-quinol...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccc(F)cc4F)cc3)c2cc1OC Show InChI InChI=1S/C24H19F2N3O4/c1-31-22-12-17-20(13-23(22)32-2)27-10-9-21(17)33-16-6-4-15(5-7-16)28-24(30)29-19-8-3-14(25)11-18(19)26/h3-13H,1-2H3,(H2,28,29,30) | PDB
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PubMed
| n/a | n/a | 3.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Kirin Brewery Co. Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of platelet-derived growth factor receptor alpha |
J Med Chem 48: 1359-66 (2005)
Article DOI: 10.1021/jm030427r
BindingDB Entry DOI: 10.7270/Q23J3CG1 |
More data for this
Ligand-Target Pair | |
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