Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Stromelysin-1' and Ligand = 'BDBM50097264'   

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))	BDBM50097264 ((R)-N*1*-[(S)-2,2-dimethyl-1-((R)-1-phenyl-ethylca...) Show SMILES CCc1cc(CCC[C@H](CC(=O)NO)C(=O)N[C@H](C(=O)N[C@H](C)c2ccccc2)C(C)(C)C)ccc1-c1ccccc1 Show InChI InChI=1S/C35H45N3O4/c1-6-26-22-25(20-21-30(26)28-17-11-8-12-18-28)14-13-19-29(23-31(39)38-42)33(40)37-32(35(3,4)5)34(41)36-24(2)27-15-9-7-10-16-27/h7-12,15-18,20-22,24,29,32,42H,6,13-14,19,23H2,1-5H3,(H,36,41)(H,37,40)(H,38,39)/t24-,29-,32-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	447	n/a	n/a	n/a	n/a	n/a	n/a
Pomona College Curated by ChEMBL					Assay Description Inhibition of MMP3				Bioorg Med Chem 15: 2223-68 (2007) Article DOI: 10.1016/j.bmc.2007.01.011 BindingDB Entry DOI: 10.7270/Q2571DBD
					More data for this Ligand-Target Pair
Stromelysin-1 (Homo sapiens (Human))	BDBM50097264 ((R)-N*1*-[(S)-2,2-dimethyl-1-((R)-1-phenyl-ethylca...) Show SMILES CCc1cc(CCC[C@H](CC(=O)NO)C(=O)N[C@H](C(=O)N[C@H](C)c2ccccc2)C(C)(C)C)ccc1-c1ccccc1 Show InChI InChI=1S/C35H45N3O4/c1-6-26-22-25(20-21-30(26)28-17-11-8-12-18-28)14-13-19-29(23-31(39)38-42)33(40)37-32(35(3,4)5)34(41)36-24(2)27-15-9-7-10-16-27/h7-12,15-18,20-22,24,29,32,42H,6,13-14,19,23H2,1-5H3,(H,36,41)(H,37,40)(H,38,39)/t24-,29-,32-/m1/s1	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	450	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Concentration required to inhibit the catalytic domain Matrix metalloprotease-3 using Nagase fluorogenic as a substrate.				Bioorg Med Chem Lett 11: 571-4 (2001) BindingDB Entry DOI: 10.7270/Q22B8X9X
					More data for this Ligand-Target Pair