BDBM50135497 4-(3,5-Dimethyl-benzo[b]thiophene-2-sulfonylamino)-3-methanesulfonyl-benzoic acid methyl ester::CHEMBL131795

SMILES: COC(=O)c1ccc(NS(=O)(=O)c2sc3ccc(C)cc3c2C)c(c1)S(C)(=O)=O

InChI Key: InChIKey=IUFSBHWVVCGHPE-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50135497   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Chymase (Homo sapiens (Human))	BDBM50135497 (4-(3,5-Dimethyl-benzo[b]thiophene-2-sulfonylamino)...) Show SMILES COC(=O)c1ccc(NS(=O)(=O)c2sc3ccc(C)cc3c2C)c(c1)S(C)(=O)=O Show InChI InChI=1S/C19H19NO6S3/c1-11-5-8-16-14(9-11)12(2)19(27-16)29(24,25)20-15-7-6-13(18(21)26-3)10-17(15)28(4,22)23/h5-10,20H,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	325	n/a	n/a	n/a	n/a	n/a	n/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