Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium channel protein type 9 subunit alpha' and Ligand = 'BDBM50164041'   

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
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM50164041 ((1S,2S)-Cyclopentane-1,2-dicarboxylic acid 1-[(2''...) Show SMILES NS(=O)(=O)c1ccccc1-c1ccc(CNC(=O)[C@H]2CCC[C@@H]2C(=O)NCc2ccc(cc2)-c2ccccc2C(F)(F)F)cc1 Show InChI InChI=1S/C34H32F3N3O4S/c35-34(36,37)30-10-3-1-6-26(30)24-16-12-22(13-17-24)20-39-32(41)28-8-5-9-29(28)33(42)40-21-23-14-18-25(19-15-23)27-7-2-4-11-31(27)45(38,43)44/h1-4,6-7,10-19,28-29H,5,8-9,20-21H2,(H,39,41)(H,40,42)(H2,38,43,44)/t28-,29-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	510	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibitory constant against voltage-gated sodium channel Nav1.7 in electrophysiology assays (EP)				Bioorg Med Chem Lett 15: 1901-7 (2005) Article DOI: 10.1016/j.bmcl.2005.02.002 BindingDB Entry DOI: 10.7270/Q2HH6JMD
					More data for this Ligand-Target Pair
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM50164041 ((1S,2S)-Cyclopentane-1,2-dicarboxylic acid 1-[(2''...) Show SMILES NS(=O)(=O)c1ccccc1-c1ccc(CNC(=O)[C@H]2CCC[C@@H]2C(=O)NCc2ccc(cc2)-c2ccccc2C(F)(F)F)cc1 Show InChI InChI=1S/C34H32F3N3O4S/c35-34(36,37)30-10-3-1-6-26(30)24-16-12-22(13-17-24)20-39-32(41)28-8-5-9-29(28)33(42)40-21-23-14-18-25(19-15-23)27-7-2-4-11-31(27)45(38,43)44/h1-4,6-7,10-19,28-29H,5,8-9,20-21H2,(H,39,41)(H,40,42)(H2,38,43,44)/t28-,29-/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	370	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory concentration against voltage-gated sodium channel Nav1.7 in voltage-ion-probe-reader (VIPR) assay				Bioorg Med Chem Lett 15: 1901-7 (2005) Article DOI: 10.1016/j.bmcl.2005.02.002 BindingDB Entry DOI: 10.7270/Q2HH6JMD
					More data for this Ligand-Target Pair