Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 427.3 BDBM50232956

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cystic fibrosis transmembrane conductance regulator (Homo sapiens (Human))	BDBM50232956 (CHEMBL4097536) Show SMILES CCN(CC)c1nc(Nc2cccc(F)c2)nc(OC(C(F)(F)F)C(F)(F)F)n1 Show InChI InChI=1S/C16H16F7N5O/c1-3-28(4-2)13-25-12(24-10-7-5-6-9(17)8-10)26-14(27-13)29-11(15(18,19)20)16(21,22)23/h5-8,11H,3-4H2,1-2H3,(H,24,25,26,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	140	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Activation of human CFTR expressed in FRT cells co-expressing YFP assessed as increase in forskolin-stimulated iodide influx measured after 10 mins f...				J Med Chem 60: 1210-1218 (2017) Article DOI: 10.1021/acs.jmedchem.6b01792 BindingDB Entry DOI: 10.7270/Q2ZC8540
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