BDBM50099010 (S)-3-Fluoromethyl-7-methoxy-5,5,8-trioxo-5lambda*6*-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid::CHEMBL10695

SMILES: CO[C@@H]1C2N(C1=O)C(C(O)=O)=C(CF)CS2(=O)=O

InChI Key: InChIKey=ZHFUFTBSJHICEZ-UUEFVBAFSA-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 = 50099010   

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))	BDBM50099010 ((S)-3-Fluoromethyl-7-methoxy-5,5,8-trioxo-5lambda*...) Show SMILES CO[C@@H]1C2N(C1=O)C(C(O)=O)=C(CF)CS2(=O)=O |t:11| Show InChI InChI=1S/C9H10FNO6S/c1-17-6-7(12)11-5(9(13)14)4(2-10)3-18(15,16)8(6)11/h6,8H,2-3H2,1H3,(H,13,14)/t6-,8?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
INETI Curated by ChEMBL					Assay Description Second-order rate constant for the inhibition of human leukocyte elastase				Bioorg Med Chem Lett 11: 1065-8 (2001) BindingDB Entry DOI: 10.7270/Q2X929K6
					More data for this Ligand-Target Pair