Reaction Details | |||
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Target | Sodium channel protein type 9 subunit alpha | ||
Ligand | BDBM217696 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1705665 (CHEMBL4056898) | ||
IC50 | 5.0±n/a nM | ||
Citation | Schenkel, LB; DiMauro, EF; Nguyen, HN; Chakka, N; Du, B; Foti, RS; Guzman-Perez, A; Jarosh, M; La, DS; Ligutti, J; Milgram, BC; Moyer, BD; Peterson, EA; Roberts, J; Yu, VL; Weiss, MM Discovery of a biarylamide series of potent, state-dependent Na Bioorg Med Chem Lett27:3817-3824 (2017) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Sodium channel protein type 9 subunit alpha | |||
Name: | Sodium channel protein type 9 subunit alpha | ||
Synonyms: | NENA | Neuroendocrine sodium channel | Peripheral sodium channel 1 | SCN9A | SCN9A_HUMAN | Sodium channel protein type IX alpha subunit | Voltage-gated sodium channel subunit Nav1.7 | Voltage-gated sodium channel subunit alpha Nav1.7 | hNE-Na | ||
Type: | Protein | ||
Mol. Mass.: | 226375.97 | ||
Organism: | Homo sapiens (Human) | ||
Description: | Q15858 | ||
Residue: | 1988 | ||
Sequence: |
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BDBM217696 | |||
n/a | |||
Name | BDBM217696 | ||
Synonyms: | US9212182, 672 | ||
Type | Small organic molecule | ||
Emp. Form. | C27H19F3N4O4S | ||
Mol. Mass. | 552.524 | ||
SMILES | COc1cc(ccc1-n1c2ccc(cc2ccc1=O)S(=O)(=O)Nc1ncccn1)-c1cccc(c1)C(F)(F)F |(6.67,-5.39,;5.33,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;1.33,-6.93,;1.33,-5.39,;2.67,-4.62,;2.67,-3.08,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;4,-2.31,;5.33,-3.08,;-2.67,,;-3.44,-1.33,;-1.9,1.33,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-4,5.39,;-5.33,4.62,;-5.33,3.08,;2.67,-9.24,;1.33,-10.01,;1.33,-11.55,;2.67,-12.32,;4,-11.55,;4,-10.01,;5.33,-12.32,;6.67,-13.09,;4.56,-13.65,;6.1,-10.99,)| | ||
Structure |