BDBM50354885 CHEMBL1834511

SMILES: CCOC(=O)c1cc(n[nH]1)-c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1

InChI Key: InChIKey=ZDTIJBVPDVWQCK-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50354885   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Acrosin (Homo sapiens (Human))	BDBM50354885 (CHEMBL1834511) Show SMILES CCOC(=O)c1cc(n[nH]1)-c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1 Show InChI InChI=1S/C19H19N3O4S/c1-3-26-19(23)18-12-17(20-21-18)14-6-8-15(9-7-14)22-27(24,25)16-10-4-13(2)5-11-16/h4-12,22H,3H2,1-2H3,(H,20,21)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.20E+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-DL-arginine para-nitroanilide-HCl as substrate after 3 hrs by spectrophotometry				Bioorg Med Chem Lett 21: 5822-5 (2011) Article DOI: 10.1016/j.bmcl.2011.07.110 BindingDB Entry DOI: 10.7270/Q2Z32020
					More data for this Ligand-Target Pair