Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acrosin' and Ligand = 'BDBM50018972'   

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
Acrosin (Homo sapiens (Human))	BDBM50018972 (CHEMBL3287444) Show SMILES Cl.Cc1ccnc(NC(=O)c2cc(on2)-c2ccc(NC(N)=N)cc2)c1 Show InChI InChI=1S/C17H16N6O2.ClH/c1-10-6-7-20-15(8-10)22-16(24)13-9-14(25-23-13)11-2-4-12(5-3-11)21-17(18)19;/h2-9H,1H3,(H4,18,19,21)(H,20,22,24);1H	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.14E+4	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human acrosin using N-alpha-benzoyl-L-arginine p-nitroanilide as substrate after 3 hrs by spectrophotometry				Bioorg Med Chem Lett 24: 2802-6 (2014) Article DOI: 10.1016/j.bmcl.2014.04.118 BindingDB Entry DOI: 10.7270/Q2J38V4S
					More data for this Ligand-Target Pair