Reaction Details | |||
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Target | Apoptosis regulator Bcl-2 | ||
Ligand | BDBM356966 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | TR-FRET (Time-Resolved Fluorescence-Resonance-Energy-Transfer) assay | ||
Ki | <0.010±n/a nM | ||
Citation | Catron, N; Lindley, D; Miller, JM; Schmitt, EA; Tong, P Solid dispersions containing an apoptosis-inducing agent US Patent US10213433 Publication Date 2/26/2019 | ||
More Info.: | Get all data from this article, Assay Method | ||
Apoptosis regulator Bcl-2 | |||
Name: | Apoptosis regulator Bcl-2 | ||
Synonyms: | Apoptosis regulator Bcl-2 Protein | B-cell lymphoma 2 protein (Bcl-2) | BCL-2 | BCL2 | BCL2_HUMAN | Bcl-2 Protein | ||
Type: | Homodimer or heterodimer | ||
Mol. Mass.: | 26269.11 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P10415 | ||
Residue: | 239 | ||
Sequence: |
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BDBM356966 | |||
n/a | |||
Name | BDBM356966 | ||
Synonyms: | N-({5-chloro-6-[(cis-1-fluoro-4-hydroxycyclohexyl)methoxy]pyridin-3-yl}sulfonyl)-4-(4-{[2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-en-1-yl]methyl}piperazin-1-yl)-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzamide | US10213433, Compound 350 | ||
Type | Small organic molecule | ||
Emp. Form. | C45H49Cl2FN6O6S | ||
Mol. Mass. | 891.877 | ||
SMILES | CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OC[C@@]4(F)CC[C@H](O)CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |wU:33.34,29.30,wD:29.29,c:57,(2.25,14.04,;1.48,12.71,;3.02,12.71,;1.48,11.17,;.15,10.39,;-1.18,11.17,;-2.52,10.39,;-2.52,8.86,;-3.85,8.08,;-3.85,6.55,;-2.52,5.78,;-1.18,6.55,;-1.18,8.08,;-2.52,4.23,;-3.85,3.46,;-3.85,1.93,;-2.52,1.16,;-2.52,-.38,;-3.85,-1.16,;-1.18,-1.16,;-1.18,-2.7,;-2.72,-2.7,;.36,-2.7,;-1.18,-4.23,;-2.52,-5,;-2.52,-6.55,;-1.18,-7.32,;-1.18,-8.86,;-2.52,-9.63,;-2.52,-11.17,;-1.18,-10.39,;-3.85,-11.93,;-3.85,-13.48,;-2.52,-14.24,;-2.52,-15.79,;-1.18,-13.48,;-1.18,-11.93,;.15,-6.55,;1.48,-7.32,;.15,-5,;-1.18,1.93,;.15,1.16,;1.48,1.93,;1.48,3.46,;2.82,4.23,;4.15,3.46,;5.61,3.94,;6.52,2.7,;5.61,1.45,;4.15,1.93,;2.82,1.16,;-1.18,3.46,;-1.18,12.71,;.15,13.48,;-2.52,13.48,;-3.85,12.71,;-5.19,13.48,;-5.19,15.01,;-6.52,15.79,;-3.85,15.79,;-2.52,15.01,)| | ||
Structure |