Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Stromelysin-1' and Ligand = 'BDBM50282555'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Stromelysin-1 (Homo sapiens (Human))	BDBM50282555 (({(S)-2-[(1-Acetyl-pyrrolidine-2-carbonyl)-amino]-...) Show SMILES CC(C)C[C@H](NC(=O)C(CCc1ccccc1)CP(O)(=O)CNC(=O)[C@H](C)NC(=O)C1CCCN1C(C)=O)C(=O)Nc1ccccc1 Show InChI InChI=1S/C34H48N5O7P/c1-23(2)20-29(33(43)37-28-14-9-6-10-15-28)38-32(42)27(18-17-26-12-7-5-8-13-26)21-47(45,46)22-35-31(41)24(3)36-34(44)30-16-11-19-39(30)25(4)40/h5-10,12-15,23-24,27,29-30H,11,16-22H2,1-4H3,(H,35,41)(H,36,44)(H,37,43)(H,38,42)(H,45,46)/t24-,27?,29-,30?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibition of human recombinant stromelysin-1.				Bioorg Med Chem Lett 4: 1221-1224 (1994) Article DOI: 10.1016/S0960-894X(01)80334-6 BindingDB Entry DOI: 10.7270/Q2125SM3
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