Reaction Details | |||
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Target | ATP-dependent translocase ABCB1 | ||
Ligand | BDBM50249649 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_498569 (CHEMBL1021068) | ||
IC50 | 4900±n/a nM | ||
Citation | Gannon, MK; Holt, JJ; Bennett, SM; Wetzel, BR; Loo, TW; Bartlett, MC; Clarke, DM; Sawada, GA; Higgins, JW; Tombline, G; Raub, TJ; Detty, MR Rhodamine inhibitors of P-glycoprotein: an amide/thioamide"switch" for ATPase activity. J Med Chem52:3328-41 (2009) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
ATP-dependent translocase ABCB1 | |||
Name: | ATP-dependent translocase ABCB1 | ||
Synonyms: | ABCB1 | MDR1 | MDR1_HUMAN | Multidrug Resistance Transporter MDR 1 | Multidrug resistance protein 1 | Multidrug resistance protein 1/Multidrug resistance associated protein 1 | P-glycoprotein (P-gp) | P-glycoprotein 1 | PGY1 | ||
Type: | Protein | ||
Mol. Mass.: | 141503.50 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P08183 | ||
Residue: | 1280 | ||
Sequence: |
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BDBM50249649 | |||
n/a | |||
Name | BDBM50249649 | ||
Synonyms: | CHEMBL490121 | Dimethyl-(8-phenyl-2,3,5,6-tetrahydro-1H,4H-13-selena-3a-aza-benzo[de]naphthacen-11-ylidene)-ammonium hexafluoro phosphate | ||
Type | Small organic molecule | ||
Emp. Form. | C27H27N2Se | ||
Mol. Mass. | 458.48 | ||
SMILES | C[N+](C)=c1ccc2c(-c3ccccc3)c3cc4CCCN5CCCc(c45)c3[se]c2c1 |(13.3,-12.67,;13.29,-11.13,;14.62,-10.36,;11.95,-10.37,;11.94,-8.8,;10.58,-8.04,;9.24,-8.82,;7.89,-8.05,;7.89,-6.51,;6.55,-5.76,;6.55,-4.22,;7.88,-3.44,;9.22,-4.21,;9.22,-5.74,;6.56,-8.84,;5.22,-8.07,;3.89,-8.85,;2.56,-8.08,;1.23,-8.84,;1.22,-10.38,;2.56,-11.16,;2.56,-12.7,;3.89,-13.47,;5.22,-12.7,;5.22,-11.16,;3.89,-10.39,;6.56,-10.39,;7.91,-11.16,;9.25,-10.39,;10.6,-11.16,)| | ||
Structure |