Reaction Details | |||
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Target | ALK tyrosine kinase receptor | ||
Ligand | BDBM50159517 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1568745 (CHEMBL3791910) | ||
IC50 | 5±n/a nM | ||
Citation | Zhang, P; Dong, J; Zhong, B; Zhang, D; Yuan, H; Jin, C; Xu, X; Li, H; Zhou, Y; Liang, Z; Ji, M; Xu, T; Song, G; Zhang, L; Chen, G; Meng, X; Sun, D; Shih, J; Zhang, R; Hou, G; Wang, C; Jin, Y; Yang, Q Design and synthesis of novel 3-sulfonylpyrazol-4-amino pyrimidines as potent anaplastic lymphoma kinase (ALK) inhibitors. Bioorg Med Chem Lett26:1910-8 (2016) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
ALK tyrosine kinase receptor | |||
Name: | ALK tyrosine kinase receptor | ||
Synonyms: | ALK | ALK tyrosine kinase receptor (ALK) | ALK_HUMAN | Anaplastic lymphoma kinase | CD_antigen: CD246 | ||
Type: | Protein | ||
Mol. Mass.: | 176453.10 | ||
Organism: | Homo sapiens (Human) | ||
Description: | Q9UM73 | ||
Residue: | 1620 | ||
Sequence: |
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BDBM50159517 | |||
n/a | |||
Name | BDBM50159517 | ||
Synonyms: | CHEMBL3785928 | ||
Type | Small organic molecule | ||
Emp. Form. | C30H42ClN7O3S | ||
Mol. Mass. | 616.218 | ||
SMILES | CC(C)N[C@H]1CC[C@@H](CC1)c1cc(OC2CC2)c(Nc2ncc(Cl)c(Nc3cn(C)nc3S(=O)(=O)C(C)C)n2)cc1C |r,wU:7.10,wD:4.3,(1.33,9.7,;1.33,8.47,;2.4,7.86,;-0,7.7,;-0,6.16,;-1.34,5.39,;-1.33,3.85,;,3.08,;1.33,3.85,;1.33,5.39,;,1.54,;1.33,.77,;1.33,-.77,;2.67,-1.54,;4,-.77,;5.46,-.81,;4.69,.52,;,-1.54,;-0,-3.08,;-1.34,-3.85,;-2.67,-3.07,;-4.01,-3.84,;-4.01,-5.38,;-5.08,-5.99,;-2.68,-6.15,;-2.68,-7.7,;-1.35,-8.47,;.04,-7.83,;1.07,-8.98,;2.29,-8.85,;.3,-10.31,;-1.21,-9.99,;-2.36,-11.01,;-2.11,-12.22,;-3.28,-11.83,;-3.82,-10.52,;-4.74,-11.34,;-4.07,-9.32,;-1.34,-5.39,;-1.33,-.77,;-1.33,.77,;-2.4,1.39,)| | ||
Structure |