Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Sodium channel protein type 9 subunit alpha' and Ligand = 'BDBM457084'   

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))	BDBM457084 ((2S,3R)-2,3-dihydroxy-3-(6-(5- (4-(trifluoromethyl...) Show SMILES NC(=O)[C@@H](O)[C@H](O)c1cccc(n1)N1CCc2c(C1)cccc2-c1ccc(cc1)C(F)(F)F |r| Show InChI InChI=1S/C24H22F3N3O3/c25-24(26,27)16-9-7-14(8-10-16)17-4-1-3-15-13-30(12-11-18(15)17)20-6-2-5-19(29-20)21(31)22(32)23(28)33/h1-10,21-22,31-32H,11-13H2,(H2,28,33)/t21-,22+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	51	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue Pharma L.P. US Patent					Assay Description On the day of experimentation, cells are prepared by removing media and digesting with appropriate enzymes to suspend cells in external solution.Whol...				US Patent US10738026 (2020) BindingDB Entry DOI: 10.7270/Q2SF307H
					More data for this Ligand-Target Pair
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM457084 ((2S,3R)-2,3-dihydroxy-3-(6-(5- (4-(trifluoromethyl...) Show SMILES NC(=O)[C@@H](O)[C@H](O)c1cccc(n1)N1CCc2c(C1)cccc2-c1ccc(cc1)C(F)(F)F |r| Show InChI InChI=1S/C24H22F3N3O3/c25-24(26,27)16-9-7-14(8-10-16)17-4-1-3-15-13-30(12-11-18(15)17)20-6-2-5-19(29-20)21(31)22(32)23(28)33/h1-10,21-22,31-32H,11-13H2,(H2,28,33)/t21-,22+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	51	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Manual Electrophysiology: On the day of experimentation, the 35 mm dish is placed on the stage of an inverted microscope equipped with a perfusion sy...				Citation and Details BindingDB Entry DOI: 10.7270/Q22J6G2Q
					More data for this Ligand-Target Pair
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM457084 ((2S,3R)-2,3-dihydroxy-3-(6-(5- (4-(trifluoromethyl...) Show SMILES NC(=O)[C@@H](O)[C@H](O)c1cccc(n1)N1CCc2c(C1)cccc2-c1ccc(cc1)C(F)(F)F |r| Show InChI InChI=1S/C24H22F3N3O3/c25-24(26,27)16-9-7-14(8-10-16)17-4-1-3-15-13-30(12-11-18(15)17)20-6-2-5-19(29-20)21(31)22(32)23(28)33/h1-10,21-22,31-32H,11-13H2,(H2,28,33)/t21-,22+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	251	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...				Citation and Details BindingDB Entry DOI: 10.7270/Q22J6G2Q
					More data for this Ligand-Target Pair
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM457084 ((2S,3R)-2,3-dihydroxy-3-(6-(5- (4-(trifluoromethyl...) Show SMILES NC(=O)[C@@H](O)[C@H](O)c1cccc(n1)N1CCc2c(C1)cccc2-c1ccc(cc1)C(F)(F)F |r| Show InChI InChI=1S/C24H22F3N3O3/c25-24(26,27)16-9-7-14(8-10-16)17-4-1-3-15-13-30(12-11-18(15)17)20-6-2-5-19(29-20)21(31)22(32)23(28)33/h1-10,21-22,31-32H,11-13H2,(H2,28,33)/t21-,22+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	251	n/a	n/a	n/a	n/a	n/a	n/a
Purdue Pharma L.P. US Patent					Assay Description The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL of 10×HBSS th...				US Patent US10738026 (2020) BindingDB Entry DOI: 10.7270/Q2SF307H
					More data for this Ligand-Target Pair