BDBM97627 US8470843, 3

SMILES: OC1CN(CCC11CCN(C1=O)c1ccc(OC(F)(F)F)cc1)S(=O)(=O)c1cccnc1Cl

InChI Key: InChIKey=GVXGNEDHEKXWSX-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 = 97627   

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
Hormone-sensitive lipase (HSL) (Homo sapiens (Human))	BDBM97627 (US8470843, 3) Show SMILES OC1CN(CCC11CCN(C1=O)c1ccc(OC(F)(F)F)cc1)S(=O)(=O)c1cccnc1Cl Show InChI InChI=1S/C20H19ClF3N3O5S/c21-17-15(2-1-9-25-17)33(30,31)26-10-7-19(16(28)12-26)8-11-27(18(19)29)13-3-5-14(6-4-13)32-20(22,23)24/h1-6,9,16,28H,7-8,10-12H2	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	20	n/a	n/a	n/a	n/a	7.2	4
Hoffmann-La Roche Inc. US Patent					Assay Description HSL enzyme activity was measured by a colorimetric assay using 2,3-dimercapto-1-propanol tributyrate (Aldrich, St. Louis, MO) as a substrate.				US Patent US8470843 (2013) BindingDB Entry DOI: 10.7270/Q2WH2NMJ
					More data for this Ligand-Target Pair