Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Stromelysin-1' and Ligand = 'BDBM50457776'   

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))	BDBM50457776 (CHEMBL4208646) Show SMILES COc1ccc(cc1-c1c(O)cc(O)c2c1oc(cc2=O)-c1ccc(O)cc1)C1CC(=O)c2c(O)cc(O)cc2O1 |(41.47,-11.31,;40.14,-12.08,;38.8,-11.32,;38.8,-9.76,;37.46,-9,;36.13,-9.77,;36.13,-11.32,;37.46,-12.09,;37.46,-13.63,;36.14,-14.41,;34.8,-13.65,;36.15,-15.94,;37.48,-16.71,;37.49,-18.25,;38.81,-15.94,;38.81,-14.39,;40.14,-13.62,;41.48,-14.39,;41.48,-15.94,;40.14,-16.7,;40.14,-18.24,;42.81,-13.62,;44.14,-14.39,;45.48,-13.63,;45.48,-12.08,;46.81,-11.31,;44.13,-11.31,;42.8,-12.09,;34.8,-9,;34.8,-7.46,;33.47,-6.69,;33.47,-5.15,;32.14,-7.46,;30.81,-6.68,;30.82,-5.14,;29.48,-7.44,;29.47,-8.99,;28.14,-9.76,;30.8,-9.76,;32.13,-8.99,;33.46,-9.77,)| Show InChI InChI=1S/C31H22O10/c1-39-24-7-4-15(26-12-22(37)29-19(34)9-17(33)10-27(29)40-26)8-18(24)28-20(35)11-21(36)30-23(38)13-25(41-31(28)30)14-2-5-16(32)6-3-14/h2-11,13,26,32-36H,12H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.43E+4	n/a	n/a	n/a	n/a	n/a	n/a
Guangxi Normal University Curated by ChEMBL					Assay Description Inhibition of recombinant human MMP3 preincubated for 30 mins followed by McaPro-Leu-Gly-Leu-Dpa-Ala-Arg-NH2 substrate addition measured by fluoresce...				Bioorg Med Chem Lett 28: 2413-2417 (2018) Article DOI: 10.1016/j.bmcl.2018.06.024 BindingDB Entry DOI: 10.7270/Q2348P07
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