BDBM50516762 CHEMBL4474485

SMILES: OB1N(Cc2ccccc2)N=Cc2ccsc12

InChI Key: InChIKey=HSTIRJHBTZBFIS-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 = 50516762   

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
Leukocyte elastase (Homo sapiens (Human))	BDBM50516762 (CHEMBL4474485) Show SMILES OB1N(Cc2ccccc2)N=Cc2ccsc12 |c:11| Show InChI InChI=1S/C12H11BN2OS/c16-13-12-11(6-7-17-12)8-14-15(13)9-10-4-2-1-3-5-10/h1-8,16H,9H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
S£o Paulo State University Curated by ChEMBL					Assay Description Inhibition of human neutrophil Elastase				Eur J Med Chem 179: 791-804 (2019) Article DOI: 10.1016/j.ejmech.2019.06.092
					More data for this Ligand-Target Pair