BDBM50349991 CHEMBL1813051

SMILES: CC(=O)Nc1cccc(Nc2cc(ncn2)N2CCC(CC2)OCc2ccc(OC(F)(F)F)cc2)c1C

InChI Key: InChIKey=NNZMWYODRJBRFI-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 = 50349991   

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
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM50349991 (CHEMBL1813051) Show SMILES CC(=O)Nc1cccc(Nc2cc(ncn2)N2CCC(CC2)OCc2ccc(OC(F)(F)F)cc2)c1C Show InChI InChI=1S/C26H28F3N5O3/c1-17-22(32-18(2)35)4-3-5-23(17)33-24-14-25(31-16-30-24)34-12-10-20(11-13-34)36-15-19-6-8-21(9-7-19)37-26(27,28)29/h3-9,14,16,20H,10-13,15H2,1-2H3,(H,32,35)(H,30,31,33)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of human sodium channel Nav1.7 expressed in human HEK293 cells by patch-clamp electrophysiological assay				J Med Chem 54: 4427-45 (2011) Article DOI: 10.1021/jm200018k BindingDB Entry DOI: 10.7270/Q2N016W1
					More data for this Ligand-Target Pair