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Compile Data Set for Download or QSAR

Found 217 hits with Last Name = 'fukami' and Initial = 'h'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227831
PNG
(CHEMBL52242)
Show SMILES COc1cccc(CCc2ccccc2OCC(O)CN(C)C)c1
Show InChI InChI=1S/C20H27NO3/c1-21(2)14-18(22)15-24-20-10-5-4-8-17(20)12-11-16-7-6-9-19(13-16)23-3/h4-10,13,18,22H,11-12,14-15H2,1-3H3
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 1.20n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227791
PNG
(CHEMBL53815)
Show SMILES CN(C)CCCOc1ccccc1CCc1ccccc1
Show InChI InChI=1S/C19H25NO/c1-20(2)15-8-16-21-19-12-7-6-11-18(19)14-13-17-9-4-3-5-10-17/h3-7,9-12H,8,13-16H2,1-2H3
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 4.60n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227978
PNG
(CHEMBL53316)
Show SMILES CN(C)CCOc1ccccc1CCc1ccccc1
Show InChI InChI=1S/C18H23NO/c1-19(2)14-15-20-18-11-7-6-10-17(18)13-12-16-8-4-3-5-9-16/h3-11H,12-15H2,1-2H3
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 6.30n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50228190
PNG
(CHEMBL54263)
Show SMILES CN(C)CCCCOc1ccccc1CCc1ccccc1
Show InChI InChI=1S/C20H27NO/c1-21(2)16-8-9-17-22-20-13-7-6-12-19(20)15-14-18-10-4-3-5-11-18/h3-7,10-13H,8-9,14-17H2,1-2H3
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 9.80n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227787
PNG
(CHEMBL1743933)
Show SMILES Cl.COc1cccc(CCc2ccccc2OCCCCN(C)C)c1
Show InChI InChI=1S/C21H29NO2/c1-22(2)15-6-7-16-24-21-12-5-4-10-19(21)14-13-18-9-8-11-20(17-18)23-3/h4-5,8-12,17H,6-7,13-16H2,1-3H3
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 13n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227837
PNG
(CHEMBL52131)
Show SMILES CN(C)CC(O)COc1ccccc1CCc1ccccc1
Show InChI InChI=1S/C19H25NO2/c1-20(2)14-18(21)15-22-19-11-7-6-10-17(19)13-12-16-8-4-3-5-9-16/h3-11,18,21H,12-15H2,1-2H3
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 14n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50093789
PNG
(CHEMBL541829 | Succinic acid mono-(2-dimethylamino...)
Show SMILES COc1cccc(CCc2ccccc2OCC(CN(C)C)OC(=O)CCC(O)=O)c1
Show InChI InChI=1S/C24H31NO6/c1-25(2)16-21(31-24(28)14-13-23(26)27)17-30-22-10-5-4-8-19(22)12-11-18-7-6-9-20(15-18)29-3/h4-10,15,21H,11-14,16-17H2,1-3H3,(H,26,27)
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 18n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227788
PNG
(CHEMBL1743936)
Show SMILES Cl.CN(C)CCCOc1ccccc1CCc1ccc(cc1)N(C)C
Show InChI InChI=1S/C21H30N2O/c1-22(2)16-7-17-24-21-9-6-5-8-19(21)13-10-18-11-14-20(15-12-18)23(3)4/h5-6,8-9,11-12,14-15H,7,10,13,16-17H2,1-4H3
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 23n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227974
PNG
(CHEMBL298554)
Show SMILES CN(C)CCCOc1ccc(Cl)cc1CCc1ccccc1
Show InChI InChI=1S/C19H24ClNO/c1-21(2)13-6-14-22-19-12-11-18(20)15-17(19)10-9-16-7-4-3-5-8-16/h3-5,7-8,11-12,15H,6,9-10,13-14H2,1-2H3
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 26n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227976
PNG
(CHEMBL299389)
Show SMILES CN(C)CCCCCOc1ccccc1CCc1ccccc1
Show InChI InChI=1S/C21H29NO/c1-22(2)17-9-4-10-18-23-21-14-8-7-13-20(21)16-15-19-11-5-3-6-12-19/h3,5-8,11-14H,4,9-10,15-18H2,1-2H3
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 38n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227653
PNG
(CHEMBL299207)
Show SMILES CN(C)CC(COc1ccccc1CCc1cccc(F)c1)OC(=O)CCC(O)=O
Show InChI InChI=1S/C23H28FNO5/c1-25(2)15-20(30-23(28)13-12-22(26)27)16-29-21-9-4-3-7-18(21)11-10-17-6-5-8-19(24)14-17/h3-9,14,20H,10-13,15-16H2,1-2H3,(H,26,27)
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 41n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227977
PNG
(CHEMBL300631)
Show SMILES CCCCN(C)CCCCOc1ccccc1CCc1ccccc1
Show InChI InChI=1S/C23H33NO/c1-3-4-18-24(2)19-10-11-20-25-23-15-9-8-14-22(23)17-16-21-12-6-5-7-13-21/h5-9,12-15H,3-4,10-11,16-20H2,1-2H3
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 68n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227790
PNG
(CHEMBL53344)
Show SMILES CNCCCCOc1ccccc1CCc1ccccc1
Show InChI InChI=1S/C19H25NO/c1-20-15-7-8-16-21-19-12-6-5-11-18(19)14-13-17-9-3-2-4-10-17/h2-6,9-12,20H,7-8,13-16H2,1H3
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 71n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227789
PNG
(CHEMBL412653)
Show SMILES CN(C)CCCCCCOc1ccccc1CCc1ccccc1
Show InChI InChI=1S/C22H31NO/c1-23(2)18-10-3-4-11-19-24-22-15-9-8-14-21(22)17-16-20-12-6-5-7-13-20/h5-9,12-15H,3-4,10-11,16-19H2,1-2H3
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 75n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227832
PNG
(CHEMBL54101)
Show SMILES CN(CCCCOc1ccccc1CCc1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C26H31NO/c1-27(22-24-14-6-3-7-15-24)20-10-11-21-28-26-17-9-8-16-25(26)19-18-23-12-4-2-5-13-23/h2-9,12-17H,10-11,18-22H2,1H3
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 198n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50228189
PNG
(CHEMBL52710)
Show SMILES CN(C)CCCCOc1ccc(CCc2ccccc2)cc1
Show InChI InChI=1S/C20H27NO/c1-21(2)16-6-7-17-22-20-14-12-19(13-15-20)11-10-18-8-4-3-5-9-18/h3-5,8-9,12-15H,6-7,10-11,16-17H2,1-2H3
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 416n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50228052
PNG
(CHEMBL52982)
Show SMILES CN(C)CCCCOc1cccc(CCc2ccccc2)c1
Show InChI InChI=1S/C20H27NO/c1-21(2)15-6-7-16-22-20-12-8-11-19(17-20)14-13-18-9-4-3-5-10-18/h3-5,8-12,17H,6-7,13-16H2,1-2H3
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 517n/an/an/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Inhibition of 5-hydroxytryptamine 2 induced vasoconstriction of rat caudal artery.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227831
PNG
(CHEMBL52242)
Show SMILES COc1cccc(CCc2ccccc2OCC(O)CN(C)C)c1
Show InChI InChI=1S/C20H27NO3/c1-21(2)14-18(22)15-24-20-10-5-4-8-17(20)12-11-16-7-6-9-19(13-16)23-3/h4-10,13,18,22H,11-12,14-15H2,1-3H3
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n/an/a 13n/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Antagonistic activity against 5-hydroxytryptamine 2 receptor on rat frontal cortex membrane.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50210107
PNG
(7-chloro-3-(4-chlorophenylsulfonyl)quinazoline-2,4...)
Show SMILES Clc1ccc(cc1)S(=O)(=O)n1c(=O)[nH]c2cc(Cl)ccc2c1=O
Show InChI InChI=1S/C14H8Cl2N2O4S/c15-8-1-4-10(5-2-8)23(21,22)18-13(19)11-6-3-9(16)7-12(11)17-14(18)20/h1-7H,(H,17,20)
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n/an/a 18n/an/an/an/an/an/a



Daiichi Asubio Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant chymase

Bioorg Med Chem Lett 17: 3431-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.038
BindingDB Entry DOI: 10.7270/Q2G160H9
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50058973
PNG
(3-(3,4-Dichloro-benzenesulfonyl)-1-phenyl-imidazol...)
Show SMILES Clc1ccc(cc1Cl)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C15H10Cl2N2O4S/c16-12-7-6-11(8-13(12)17)24(22,23)19-14(20)9-18(15(19)21)10-4-2-1-3-5-10/h1-8H,9H2
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n/an/a 18n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.

J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50058984
PNG
(3-(3,4-Dichloro-benzenesulfonyl)-1-(3,4-dimethyl-p...)
Show SMILES Cc1ccc(cc1C)N1CC(=O)N(C1=O)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C17H14Cl2N2O4S/c1-10-3-4-12(7-11(10)2)20-9-16(22)21(17(20)23)26(24,25)13-5-6-14(18)15(19)8-13/h3-8H,9H2,1-2H3
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n/an/a 20n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.

J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50058990
PNG
(3-(3,4-Dimethoxy-benzenesulfonyl)-1-(3,4-dimethyl-...)
Show SMILES COc1ccc(cc1OC)S(=O)(=O)N1C(=O)CN(C1=O)c1ccc(C)c(C)c1
Show InChI InChI=1S/C19H20N2O6S/c1-12-5-6-14(9-13(12)2)20-11-18(22)21(19(20)23)28(24,25)15-7-8-16(26-3)17(10-15)27-4/h5-10H,11H2,1-4H3
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n/an/a 22n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.

J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50210098
PNG
(6-(4,5-dichloro-2-methoxybenzyl)-4-(4-chlorophenyl...)
Show SMILES COc1cc(Cl)c(Cl)cc1CC1CNC(=O)CN(C1=O)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C19H17Cl3N2O5S/c1-29-17-8-16(22)15(21)7-11(17)6-12-9-23-18(25)10-24(19(12)26)30(27,28)14-4-2-13(20)3-5-14/h2-5,7-8,12H,6,9-10H2,1H3,(H,23,25)
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n/an/a 23n/an/an/an/an/an/a



Daiichi Asubio Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant chymase

Bioorg Med Chem Lett 17: 3431-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.038
BindingDB Entry DOI: 10.7270/Q2G160H9
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50058996
PNG
(3-(4-Chloro-benzenesulfonyl)-1-(3,4-dichloro-pheny...)
Show SMILES Clc1ccc(cc1)S(=O)(=O)N1C(=O)CN(C1=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C15H9Cl3N2O4S/c16-9-1-4-11(5-2-9)25(23,24)20-14(21)8-19(15(20)22)10-3-6-12(17)13(18)7-10/h1-7H,8H2
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n/an/a 23n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.

J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50210116
PNG
(6-(5-fluoro-2-methoxybenzyl)-4-(4-chlorophenylsulf...)
Show SMILES COc1ccc(F)cc1CC1CNC(=O)CN(C1=O)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C19H18ClFN2O5S/c1-28-17-7-4-15(21)9-12(17)8-13-10-22-18(24)11-23(19(13)25)29(26,27)16-5-2-14(20)3-6-16/h2-7,9,13H,8,10-11H2,1H3,(H,22,24)
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n/an/a 26n/an/an/an/an/an/a



Daiichi Asubio Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant chymase

Bioorg Med Chem Lett 17: 3431-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.038
BindingDB Entry DOI: 10.7270/Q2G160H9
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50210120
PNG
((S)-6-(5-chloro-2-methoxybenzyl)-4-(4-chlorophenyl...)
Show SMILES COc1ccc(Cl)cc1C[C@H]1CNC(=O)CN(C1=O)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C19H18Cl2N2O5S/c1-28-17-7-4-15(21)9-12(17)8-13-10-22-18(24)11-23(19(13)25)29(26,27)16-5-2-14(20)3-6-16/h2-7,9,13H,8,10-11H2,1H3,(H,22,24)/t13-/m0/s1
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n/an/a 27n/an/an/an/an/an/a



Daiichi Asubio Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant chymase

Bioorg Med Chem Lett 17: 3431-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.038
BindingDB Entry DOI: 10.7270/Q2G160H9
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50210094
PNG
(3-((1-(4-chlorophenylsulfonyl)-3,7-dioxo-1,4-diaze...)
Show SMILES COc1ccc(cc1CC1CNC(=O)CN(C1=O)S(=O)(=O)c1ccc(Cl)cc1)C#N
Show InChI InChI=1S/C20H18ClN3O5S/c1-29-18-7-2-13(10-22)8-14(18)9-15-11-23-19(25)12-24(20(15)26)30(27,28)17-5-3-16(21)4-6-17/h2-8,15H,9,11-12H2,1H3,(H,23,25)
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n/an/a 27n/an/an/an/an/an/a



Daiichi Asubio Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant chymase

Bioorg Med Chem Lett 17: 3431-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.038
BindingDB Entry DOI: 10.7270/Q2G160H9
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50059007
PNG
(4-(2,5-Dioxo-3-phenyl-imidazolidine-1-sulfonyl)-be...)
Show SMILES COC(=O)c1ccc(cc1)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C17H14N2O6S/c1-25-16(21)12-7-9-14(10-8-12)26(23,24)19-15(20)11-18(17(19)22)13-5-3-2-4-6-13/h2-10H,11H2,1H3
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n/an/a 29n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.

J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50058964
PNG
(3-(3,4-Dimethyl-benzenesulfonyl)-1-phenyl-imidazol...)
Show SMILES Cc1ccc(cc1C)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C17H16N2O4S/c1-12-8-9-15(10-13(12)2)24(22,23)19-16(20)11-18(17(19)21)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3
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n/an/a 30n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.

J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227791
PNG
(CHEMBL53815)
Show SMILES CN(C)CCCOc1ccccc1CCc1ccccc1
Show InChI InChI=1S/C19H25NO/c1-20(2)15-8-16-21-19-12-7-6-11-18(19)14-13-17-9-4-3-5-10-17/h3-7,9-12H,8,13-16H2,1-2H3
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n/an/a 34n/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Antagonistic activity against 5-hydroxytryptamine 2 receptor on rat frontal cortex membrane.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM100740
PNG
(CHEMBL391608 | US8507714, 29)
Show SMILES COc1ccc(Cl)cc1CC1CNC(=O)CN(C1=O)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C19H18Cl2N2O5S/c1-28-17-7-4-15(21)9-12(17)8-13-10-22-18(24)11-23(19(13)25)29(26,27)16-5-2-14(20)3-6-16/h2-7,9,13H,8,10-11H2,1H3,(H,22,24)
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n/an/a 34n/an/an/an/an/an/a



Daiichi Asubio Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant chymase

Bioorg Med Chem Lett 17: 3431-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.038
BindingDB Entry DOI: 10.7270/Q2G160H9
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50058969
PNG
(3-(4-Chloro-benzenesulfonyl)-1-(3,4-dimethyl-pheny...)
Show SMILES Cc1ccc(cc1C)N1CC(=O)N(C1=O)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H15ClN2O4S/c1-11-3-6-14(9-12(11)2)19-10-16(21)20(17(19)22)25(23,24)15-7-4-13(18)5-8-15/h3-9H,10H2,1-2H3
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n/an/a 35n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.

J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50210099
PNG
(CHEMBL246964 | rac-2q)
Show SMILES OC(=O)COc1ccc(Cl)cc1CC1CNC(=O)CN(C1=O)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H18Cl2N2O7S/c21-14-1-4-16(5-2-14)32(29,30)24-10-18(25)23-9-13(20(24)28)7-12-8-15(22)3-6-17(12)31-11-19(26)27/h1-6,8,13H,7,9-11H2,(H,23,25)(H,26,27)
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n/an/a 39n/an/an/an/an/an/a



Daiichi Asubio Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant chymase

Bioorg Med Chem Lett 17: 3431-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.038
BindingDB Entry DOI: 10.7270/Q2G160H9
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50058972
PNG
(4-(2,5-Dioxo-3-phenyl-imidazolidine-1-sulfonyl)-be...)
Show SMILES O=C1CN(C(=O)N1S(=O)(=O)c1ccc(cc1)C#N)c1ccccc1
Show InChI InChI=1S/C16H11N3O4S/c17-10-12-6-8-14(9-7-12)24(22,23)19-15(20)11-18(16(19)21)13-4-2-1-3-5-13/h1-9H,11H2
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n/an/a 40n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.

J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50210096
PNG
(2-(4-chloro-2-((1-(4-chlorophenylsulfonyl)-3,7-dio...)
Show SMILES CNC(=O)COc1ccc(Cl)cc1CC1CNC(=O)CN(C1=O)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H21Cl2N3O6S/c1-24-20(28)12-32-18-7-4-16(23)9-13(18)8-14-10-25-19(27)11-26(21(14)29)33(30,31)17-5-2-15(22)3-6-17/h2-7,9,14H,8,10-12H2,1H3,(H,24,28)(H,25,27)
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n/an/a 42n/an/an/an/an/an/a



Daiichi Asubio Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant chymase

Bioorg Med Chem Lett 17: 3431-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.038
BindingDB Entry DOI: 10.7270/Q2G160H9
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM87059
PNG
(CHEMBL247767 | Chymostatin)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)N[C@@H](Cc1ccccc1)C(O)=O)C1CCNC(N)=N1)C(=O)N[C@@H](Cc1ccccc1)C=O |c:30|
Show InChI InChI=1S/C31H41N7O6/c1-19(2)15-24(27(40)34-22(18-39)16-20-9-5-3-6-10-20)35-28(41)26(23-13-14-33-30(32)36-23)38-31(44)37-25(29(42)43)17-21-11-7-4-8-12-21/h3-12,18-19,22-26H,13-17H2,1-2H3,(H,34,40)(H,35,41)(H,42,43)(H3,32,33,36)(H2,37,38,44)/t22-,23?,24-,25-,26-/m0/s1
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n/an/a 43n/an/an/an/an/an/a



Daiichi Asubio Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant chymase

Bioorg Med Chem Lett 17: 3431-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.038
BindingDB Entry DOI: 10.7270/Q2G160H9
More data for this
Ligand-Target Pair
Chymotrypsinogen A


(Bos taurus (bovine))		BDBM50058977
PNG
(3-Benzoyl-1-phenyl-imidazolidine-2,4-dione | CHEMB...)
Show SMILES Oc1cn(-c2ccccc2)c(=O)n1C(=O)c1ccccc1
Show InChI InChI=1S/C16H12N2O3/c19-14-11-17(13-9-5-2-6-10-13)16(21)18(14)15(20)12-7-3-1-4-8-12/h1-11,19H
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n/an/a 48n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreas alpha-chymotrypsin in vitro

J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50093789
PNG
(CHEMBL541829 | Succinic acid mono-(2-dimethylamino...)
Show SMILES COc1cccc(CCc2ccccc2OCC(CN(C)C)OC(=O)CCC(O)=O)c1
Show InChI InChI=1S/C24H31NO6/c1-25(2)16-21(31-24(28)14-13-23(26)27)17-30-22-10-5-4-8-19(22)12-11-18-7-6-9-20(15-18)29-3/h4-10,15,21H,11-14,16-17H2,1-3H3,(H,26,27)
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n/an/a 51n/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Antagonistic activity against 5-hydroxytryptamine 2 receptor on rat frontal cortex membrane.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227788
PNG
(CHEMBL1743936)
Show SMILES Cl.CN(C)CCCOc1ccccc1CCc1ccc(cc1)N(C)C
Show InChI InChI=1S/C21H30N2O/c1-22(2)16-7-17-24-21-9-6-5-8-19(21)13-10-18-11-14-20(15-12-18)23(3)4/h5-6,8-9,11-12,14-15H,7,10,13,16-17H2,1-4H3
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n/an/a 54n/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Antagonistic activity against 5-hydroxytryptamine 2 receptor on rat frontal cortex membrane.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227837
PNG
(CHEMBL52131)
Show SMILES CN(C)CC(O)COc1ccccc1CCc1ccccc1
Show InChI InChI=1S/C19H25NO2/c1-20(2)14-18(21)15-22-19-11-7-6-10-17(19)13-12-16-8-4-3-5-9-16/h3-11,18,21H,12-15H2,1-2H3
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n/an/a 55n/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Antagonistic activity against 5-hydroxytryptamine 2 receptor on rat frontal cortex membrane.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50058999
PNG
(3-(3,4-Dimethyl-benzenesulfonyl)-1-(3,4-dimethyl-p...)
Show SMILES Cc1ccc(cc1C)N1CC(=O)N(C1=O)S(=O)(=O)c1ccc(C)c(C)c1
Show InChI InChI=1S/C19H20N2O4S/c1-12-5-7-16(9-14(12)3)20-11-18(22)21(19(20)23)26(24,25)17-8-6-13(2)15(4)10-17/h5-10H,11H2,1-4H3
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n/an/a 60n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.

J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227787
PNG
(CHEMBL1743933)
Show SMILES Cl.COc1cccc(CCc2ccccc2OCCCCN(C)C)c1
Show InChI InChI=1S/C21H29NO2/c1-22(2)15-6-7-16-24-21-12-5-4-10-19(21)14-13-18-9-8-11-20(17-18)23-3/h4-5,8-12,17H,6-7,13-16H2,1-3H3
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n/an/a 62n/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Antagonistic activity against 5-hydroxytryptamine 2 receptor on rat frontal cortex membrane.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50059002
PNG
(3-(4-Chloro-benzenesulfonyl)-1-(3-chloro-phenyl)-i...)
Show SMILES Clc1ccc(cc1)S(=O)(=O)N1C(=O)CN(C1=O)c1cccc(Cl)c1
Show InChI InChI=1S/C15H10Cl2N2O4S/c16-10-4-6-13(7-5-10)24(22,23)19-14(20)9-18(15(19)21)12-3-1-2-11(17)8-12/h1-8H,9H2
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n/an/a 66n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.

J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50058975
PNG
(3-(2,5-Dioxo-3-phenyl-imidazolidine-1-sulfonyl)-be...)
Show SMILES O=C1CN(C(=O)N1S(=O)(=O)c1cccc(c1)C#N)c1ccccc1
Show InChI InChI=1S/C16H11N3O4S/c17-10-12-5-4-8-14(9-12)24(22,23)19-15(20)11-18(16(19)21)13-6-2-1-3-7-13/h1-9H,11H2
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n/an/a 68n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.

J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50058994
PNG
(3-(2,5-Dioxo-3-phenyl-imidazolidine-1-sulfonyl)-be...)
Show SMILES COC(=O)c1cccc(c1)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C17H14N2O6S/c1-25-16(21)12-6-5-9-14(10-12)26(23,24)19-15(20)11-18(17(19)22)13-7-3-2-4-8-13/h2-10H,11H2,1H3
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n/an/a 82n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.

J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50210113
PNG
(6-(5-chloro-2-ethoxybenzyl)-4-(4-chlorophenylsulfo...)
Show SMILES CCOc1ccc(Cl)cc1CC1CNC(=O)CN(C1=O)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H20Cl2N2O5S/c1-2-29-18-8-5-16(22)10-13(18)9-14-11-23-19(25)12-24(20(14)26)30(27,28)17-6-3-15(21)4-7-17/h3-8,10,14H,2,9,11-12H2,1H3,(H,23,25)
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n/an/a 83n/an/an/an/an/an/a



Daiichi Asubio Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant chymase

Bioorg Med Chem Lett 17: 3431-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.038
BindingDB Entry DOI: 10.7270/Q2G160H9
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50227978
PNG
(CHEMBL53316)
Show SMILES CN(C)CCOc1ccccc1CCc1ccccc1
Show InChI InChI=1S/C18H23NO/c1-19(2)14-15-20-18-11-7-6-10-17(18)13-12-16-8-4-3-5-9-16/h3-11H,12-15H2,1-2H3
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n/an/a 96n/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Antagonistic activity against 5-hydroxytryptamine 2 receptor on rat frontal cortex membrane.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50210097
PNG
(6-(2-chlorobenzyl)-4-(4-chlorophenylsulfonyl)-1,4-...)
Show SMILES Clc1ccc(cc1)S(=O)(=O)N1CC(=O)NCC(Cc2ccccc2Cl)C1=O
Show InChI InChI=1S/C18H16Cl2N2O4S/c19-14-5-7-15(8-6-14)27(25,26)22-11-17(23)21-10-13(18(22)24)9-12-3-1-2-4-16(12)20/h1-8,13H,9-11H2,(H,21,23)
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n/an/a 110n/an/an/an/an/an/a



Daiichi Asubio Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant chymase

Bioorg Med Chem Lett 17: 3431-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.038
BindingDB Entry DOI: 10.7270/Q2G160H9
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))		BDBM50059014
PNG
(3-(3,4-Dimethoxy-benzenesulfonyl)-1-phenyl-imidazo...)
Show SMILES COc1ccc(cc1OC)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C17H16N2O6S/c1-24-14-9-8-13(10-15(14)25-2)26(22,23)19-16(20)11-18(17(19)21)12-6-4-3-5-7-12/h3-10H,11H2,1-2H3
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n/an/a 110n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.

J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50228190
PNG
(CHEMBL54263)
Show SMILES CN(C)CCCCOc1ccccc1CCc1ccccc1
Show InChI InChI=1S/C20H27NO/c1-21(2)16-8-9-17-22-20-13-7-6-12-19(20)15-14-18-10-4-3-5-11-18/h3-7,10-13H,8-9,14-17H2,1-2H3
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n/an/a 115n/an/an/an/an/an/a



Mitsubishi Kasei Corporation

Curated by ChEMBL


Assay Description
Antagonistic activity against 5-hydroxytryptamine 2 receptor on rat frontal cortex membrane.

J Med Chem 33: 1818-23 (1990)


BindingDB Entry DOI: 10.7270/Q2FB5559
More data for this
Ligand-Target Pair
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