Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Stromelysin-1' and Ligand = 'BDBM50097261'   

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))	BDBM50097261 ((R)-2-(3-(9H-fluoren-2-yl)propyl)-N1-((S)-3,3-dime...) Show SMILES C[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCc1ccc-2c(Cc3ccccc-23)c1)CC(=O)NO)C(C)(C)C)c1ccccc1 Show InChI InChI=1S/C34H41N3O4/c1-22(24-12-6-5-7-13-24)35-33(40)31(34(2,3)4)36-32(39)26(21-30(38)37-41)15-10-11-23-17-18-29-27(19-23)20-25-14-8-9-16-28(25)29/h5-9,12-14,16-19,22,26,31,41H,10-11,15,20-21H2,1-4H3,(H,35,40)(H,36,39)(H,37,38)/t22-,26-,31-/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	3.80	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))	BDBM50097261 ((R)-2-(3-(9H-fluoren-2-yl)propyl)-N1-((S)-3,3-dime...) Show SMILES C[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCc1ccc-2c(Cc3ccccc-23)c1)CC(=O)NO)C(C)(C)C)c1ccccc1 Show InChI InChI=1S/C34H41N3O4/c1-22(24-12-6-5-7-13-24)35-33(40)31(34(2,3)4)36-32(39)26(21-30(38)37-41)15-10-11-23-17-18-29-27(19-23)20-25-14-8-9-16-28(25)29/h5-9,12-14,16-19,22,26,31,41H,10-11,15,20-21H2,1-4H3,(H,35,40)(H,36,39)(H,37,38)/t22-,26-,31-/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	3.80	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