Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Disintegrin and metalloproteinase domain-containing protein 17' and Ligand = 'BDBM50243058'   

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
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50243058 (CHEMBL4087714) Show SMILES COc1ccc2CN(C[C@]3(NC(=O)NC3=O)c3cc4cnc(cc4o3)N3CCNC3=O)C(=O)c2c1 |r| Show InChI InChI=1S/C23H20N6O6/c1-34-14-3-2-12-10-28(19(30)15(12)7-14)11-23(20(31)26-21(32)27-23)17-6-13-9-25-18(8-16(13)35-17)29-5-4-24-22(29)33/h2-3,6-9H,4-5,10-11H2,1H3,(H,24,33)(H2,26,27,31,32)/t23-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck& Co. Curated by ChEMBL					Assay Description Inhibition of catalytic domain TACE (unknown origin) by FRET assay				Bioorg Med Chem Lett 27: 3037-3042 (2017) Article DOI: 10.1016/j.bmcl.2017.05.062 BindingDB Entry DOI: 10.7270/Q2319Z8G
					More data for this Ligand-Target Pair