BDBM50390079 CHEMBL2069406

SMILES: FC(F)(F)Oc1ccc(cc1)C(=O)N[C@@H]1COc2cccc(c2C1)-c1cccnc1

InChI Key: InChIKey=YAXBXTNYPVATMS-INIZCTEOSA-N

Data: 2 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 2 hits for monomerid = 50390079   

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 5 subunit alpha (Homo sapiens (Human))	BDBM50390079 (CHEMBL2069406) Show SMILES FC(F)(F)Oc1ccc(cc1)C(=O)N[C@@H]1COc2cccc(c2C1)-c1cccnc1 |r| Show InChI InChI=1S/C22H17F3N2O3/c23-22(24,25)30-17-8-6-14(7-9-17)21(28)27-16-11-19-18(15-3-2-10-26-12-15)4-1-5-20(19)29-13-16/h1-10,12,16H,11,13H2,(H,27,28)/t16-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.16E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human NaV1.5 expressed in CHO cells by IonWorks assay				Bioorg Med Chem Lett 22: 5618-24 (2012) Article DOI: 10.1016/j.bmcl.2012.06.105 BindingDB Entry DOI: 10.7270/Q2ZC83ZX
					More data for this Ligand-Target Pair
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM50390079 (CHEMBL2069406) Show SMILES FC(F)(F)Oc1ccc(cc1)C(=O)N[C@@H]1COc2cccc(c2C1)-c1cccnc1 |r| Show InChI InChI=1S/C22H17F3N2O3/c23-22(24,25)30-17-8-6-14(7-9-17)21(28)27-16-11-19-18(15-3-2-10-26-12-15)4-1-5-20(19)29-13-16/h1-10,12,16H,11,13H2,(H,27,28)/t16-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human NaV1.7 expressed in HEK293 cells by whole-cell voltage clamp assay				Bioorg Med Chem Lett 22: 5618-24 (2012) Article DOI: 10.1016/j.bmcl.2012.06.105 BindingDB Entry DOI: 10.7270/Q2ZC83ZX
					More data for this Ligand-Target Pair