BDBM196500 US10202344, Compound 141::US9212139, 141

SMILES: OC[C@@H](O)Cc1cn(-c2ccc(Oc3ccc(c(c3)C#N)C(F)(F)F)cc2)c2cccc(C(O)CO)c12

InChI Key: InChIKey=GNUYUSPVVVZQGI-UBDBMELISA-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 = 196500   

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))	BDBM196500 (US10202344, Compound 141 | US9212139, 141) Show SMILES OC[C@@H](O)Cc1cn(-c2ccc(Oc3ccc(c(c3)C#N)C(F)(F)F)cc2)c2cccc(C(O)CO)c12 |r| Show InChI InChI=1S/C27H23F3N2O5/c28-27(29,30)23-9-8-21(11-16(23)12-31)37-20-6-4-18(5-7-20)32-13-17(10-19(35)14-33)26-22(25(36)15-34)2-1-3-24(26)32/h1-9,11,13,19,25,33-36H,10,14-15H2/t19-,25?/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.97E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue Pharma L.P. US Patent					Assay Description Recombinant Nav1.7 Cell Line: In vitro assays were performed in a recombinant cell line expressing cDNA encoding the alpha subunit (Nav1.7, SCN9a, PN...				US Patent US10202344 (2019) BindingDB Entry DOI: 10.7270/Q2X350KJ
					More data for this Ligand-Target Pair
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM196500 (US10202344, Compound 141 | US9212139, 141) Show SMILES OC[C@@H](O)Cc1cn(-c2ccc(Oc3ccc(c(c3)C#N)C(F)(F)F)cc2)c2cccc(C(O)CO)c12 |r| Show InChI InChI=1S/C27H23F3N2O5/c28-27(29,30)23-9-8-21(11-16(23)12-31)37-20-6-4-18(5-7-20)32-13-17(10-19(35)14-33)26-22(25(36)15-34)2-1-3-24(26)32/h1-9,11,13,19,25,33-36H,10,14-15H2/t19-,25?/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.97E+3	n/a	n/a	n/a	n/a	7.3	n/a
Purdue Pharma, L.P. US Patent					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...				US Patent US9212139 (2015) BindingDB Entry DOI: 10.7270/Q26Q1W19
					More data for this Ligand-Target Pair