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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Chymase' and Ligand = 'BDBM50135507'   
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
Chymase


(Homo sapiens (Human))		BDBM50135507
PNG
(4-(5-Chloro-3-methyl-benzo[b]thiophene-2-sulfonyla...)
Show SMILES COC(=O)c1ccc(NS(=O)(=O)c2sc3ccc(Cl)cc3c2C)c(c1)[N+]([O-])=O
Show InChI InChI=1S/C17H13ClN2O6S2/c1-9-12-8-11(18)4-6-15(12)27-17(9)28(24,25)19-13-5-3-10(16(21)26-2)7-14(13)20(22)23/h3-8,19H,1-2H3
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MMDB

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n/an/a 880n/an/an/an/an/an/a



Toa Eiyo Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against human chymase

Bioorg Med Chem Lett 13: 4085-8 (2003)


BindingDB Entry DOI: 10.7270/Q2QN665P
More data for this
Ligand-Target Pair