BDBM50309169 (2R,3R)-2,3-dihydroxy-4-oxo-4-(3-phenylpyrrolidin-1-yl)-N-(2-(thiophen-2-yl)ethyl)butanamide::CHEMBL596906

SMILES: O[C@H]([C@@H](O)C(=O)N1CCC(C1)c1ccccc1)C(=O)NCCc1cccs1

InChI Key: InChIKey=MXXIVLDAVSWDON-HSFDIDPMSA-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 = 50309169   

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))	BDBM50309169 ((2R,3R)-2,3-dihydroxy-4-oxo-4-(3-phenylpyrrolidin-...) Show SMILES O[C@H]([C@@H](O)C(=O)N1CCC(C1)c1ccccc1)C(=O)NCCc1cccs1 |r| Show InChI InChI=1S/C20H24N2O4S/c23-17(19(25)21-10-8-16-7-4-12-27-16)18(24)20(26)22-11-9-15(13-22)14-5-2-1-3-6-14/h1-7,12,15,17-18,23-24H,8-11,13H2,(H,21,25)/t15?,17-,18-/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	456	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