BDBM50162506 2-[2-(4-Chloro-3-methyl-phenyl)-2-oxo-ethylsulfanyl]-6-oxo-4-thiophen-2-yl-1,6-dihydro-pyrimidine-5-carbonitrile::CHEMBL195530

SMILES: Cc1cc(ccc1Cl)C(=O)CSc1nc(-c2cccs2)c(C#N)c(=O)[nH]1

InChI Key: InChIKey=SRKGVOUOXSXNFL-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 = 50162506   

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
Serpin H1 (Homo sapiens (Human))	BDBM50162506 (2-[2-(4-Chloro-3-methyl-phenyl)-2-oxo-ethylsulfany...) Show SMILES Cc1cc(ccc1Cl)C(=O)CSc1nc(-c2cccs2)c(C#N)c(=O)[nH]1 Show InChI InChI=1S/C18H12ClN3O2S2/c1-10-7-11(4-5-13(10)19)14(23)9-26-18-21-16(15-3-2-6-25-15)12(8-20)17(24)22-18/h2-7H,9H2,1H3,(H,21,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
McMaster University Curated by ChEMBL					Assay Description Inhibitory concentration against Hsp47 collagen chaperone in turbidity assay				J Med Chem 48: 1680-4 (2005) Article DOI: 10.1021/jm049148+ BindingDB Entry DOI: 10.7270/Q2B27TRV
					More data for this Ligand-Target Pair