BDBM50382090 CHEMBL2022136

SMILES: COC(=O)Nc1nc2ccc(cc2[nH]1)S(=O)(=O)NCc1ccccc1F

InChI Key: InChIKey=DTKNOWQDOJHYJU-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 = 50382090   

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))	BDBM50382090 (CHEMBL2022136) Show SMILES COC(=O)Nc1nc2ccc(cc2[nH]1)S(=O)(=O)NCc1ccccc1F Show InChI InChI=1S/C16H15FN4O4S/c1-25-16(22)21-15-19-13-7-6-11(8-14(13)20-15)26(23,24)18-9-10-4-2-3-5-12(10)17/h2-8,18H,9H2,1H3,(H2,19,20,21,22)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.10E+5	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of acrosin in human spermatozoa assessed as effect on amidase activity after 3 hrs incubation by spectrophotometry				Bioorg Med Chem Lett 22: 3554-9 (2012) Article DOI: 10.1016/j.bmcl.2012.03.042 BindingDB Entry DOI: 10.7270/Q2HT2QBG
					More data for this Ligand-Target Pair