Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 385.4 BDBM50237282

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))	BDBM50237282 (CHEMBL4096257) Show SMILES Cc1cc2nc(-c3cccc(c3)[N+]([O-])=O)c(=O)n(Cc3ccccc3)c2cc1C Show InChI InChI=1S/C23H19N3O3/c1-15-11-20-21(12-16(15)2)25(14-17-7-4-3-5-8-17)23(27)22(24-20)18-9-6-10-19(13-18)26(28)29/h3-13H,14H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description In vitro inhibition of geranylgeranyl-protein transferase type-I				J Med Chem 60: 2401-2410 (2017) Article DOI: 10.1021/acs.jmedchem.6b01759 BindingDB Entry DOI: 10.7270/Q2SN0C70
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