BDBM50390098 CHEMBL2069415

SMILES: Cc1cc(cnc1CO)-c1cccc2OC[C@H](Cc12)NC(=O)c1ccc(OCCOCC(F)(F)F)nc1

InChI Key: InChIKey=ZFXRHMDWEZEBTB-IBGZPJMESA-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 = 50390098   

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))	BDBM50390098 (CHEMBL2069415) Show SMILES Cc1cc(cnc1CO)-c1cccc2OC[C@H](Cc12)NC(=O)c1ccc(OCCOCC(F)(F)F)nc1 |r| Show InChI InChI=1S/C26H26F3N3O5/c1-16-9-18(12-30-22(16)13-33)20-3-2-4-23-21(20)10-19(14-37-23)32-25(34)17-5-6-24(31-11-17)36-8-7-35-15-26(27,28)29/h2-6,9,11-12,19,33H,7-8,10,13-15H2,1H3,(H,32,34)/t19-/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	794	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
Sodium channel protein type 5 subunit alpha (Homo sapiens (Human))	BDBM50390098 (CHEMBL2069415) Show SMILES Cc1cc(cnc1CO)-c1cccc2OC[C@H](Cc12)NC(=O)c1ccc(OCCOCC(F)(F)F)nc1 |r| Show InChI InChI=1S/C26H26F3N3O5/c1-16-9-18(12-30-22(16)13-33)20-3-2-4-23-21(20)10-19(14-37-23)32-25(34)17-5-6-24(31-11-17)36-8-7-35-15-26(27,28)29/h2-6,9,11-12,19,33H,7-8,10,13-15H2,1H3,(H,32,34)/t19-/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	5.01E+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