BDBM50309162 (2R,3R)-N-((4-(2-chlorobenzyl)thiophen-2-yl)methyl)-4-(2-(3-chlorophenyl)pyrrolidin-1-yl)-2,3-dihydroxy-4-thioxobutanamide::CHEMBL602943

SMILES: O[C@H]([C@@H](O)C(=S)N1CCCC1c1cccc(Cl)c1)C(=O)NCc1cc(Cc2ccccc2Cl)cs1

InChI Key: InChIKey=BWBDNOPTZINBCC-HEYJASKDSA-N

Data: 1 KI

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 = 50309162   

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
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50309162 ((2R,3R)-N-((4-(2-chlorobenzyl)thiophen-2-yl)methyl...) Show SMILES O[C@H]([C@@H](O)C(=S)N1CCCC1c1cccc(Cl)c1)C(=O)NCc1cc(Cc2ccccc2Cl)cs1 |r| Show InChI InChI=1S/C26H26Cl2N2O3S2/c27-19-7-3-6-18(13-19)22-9-4-10-30(22)26(34)24(32)23(31)25(33)29-14-20-12-16(15-35-20)11-17-5-1-2-8-21(17)28/h1-3,5-8,12-13,15,22-24,31-32H,4,9-11,14H2,(H,29,33)/t22?,23-,24-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.52E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Cambridge Curated by ChEMBL					Assay Description Inhibition of TACE				Bioorg Med Chem Lett 20: 1189-93 (2010) Article DOI: 10.1016/j.bmcl.2009.12.004 BindingDB Entry DOI: 10.7270/Q2BK1CFB
					More data for this Ligand-Target Pair