Reaction Details | |||
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Target | Cyclin-T1/Cyclin-dependent kinase 9 | ||
Ligand | BDBM50431287 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_951368 (CHEMBL2349742) | ||
IC50 | 910±n/a nM | ||
Citation | Zatloukal, M; Jorda, R; Gucký, T; Reznícková, E; Voller, J; Pospíšil, T; Malínková, V; Adamcová, H; Kryštof, V; Strnad, M Synthesis and in vitro biological evaluation of 2,6,9-trisubstituted purines targeting multiple cyclin-dependent kinases. Eur J Med Chem61:61-72 (2013) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Cyclin-T1/Cyclin-dependent kinase 9 | |||
Name: | Cyclin-T1/Cyclin-dependent kinase 9 | ||
Synonyms: | CDK9/ Cyclin-T1 | CDK9/CycT1 | CDK9/Cyclin T | CDK9/Cyclin T1 | Cyclin T1/dependent kinase 9 | Cyclin-Dependent Kinase 9 (CDK9) | ||
Type: | Protein Complex | ||
Mol. Mass.: | n/a | ||
Description: | n/a | ||
Components: | This complex has 2 components. | ||
Component 1 | |||
Name: | Cyclin-T1 | ||
Synonyms: | CCNT1 | CCNT1_HUMAN | CycT | CycT1 | Cyclin T | Cyclin T1 | Cyclin-T | ||
Type: | Enzyme Subunit | ||
Mol. Mass.: | 80712.40 | ||
Organism: | Homo sapiens (Human) | ||
Description: | n/a | ||
Residue: | 726 | ||
Sequence: |
| ||
Component 2 | |||
Name: | Cyclin-dependent kinase 9 | ||
Synonyms: | C-2K | CDC2L4 | CDK9 | CDK9_HUMAN | Cell division cycle 2-like protein kinase 4 | Cell division protein kinase 9 | Cyclin-Dependent Kinase 9 (CDK9) | Cyclin-dependent kinase 9 (CDK9) | Serine/threonine-protein kinase PITALRE | TAK | Tat-associated kinase complex catalytic subunit | ||
Type: | Enzyme Subunit | ||
Mol. Mass.: | 42789.13 | ||
Organism: | Homo sapiens (Human) | ||
Description: | n/a | ||
Residue: | 372 | ||
Sequence: |
| ||
BDBM50431287 | |||
n/a | |||
Name | BDBM50431287 | ||
Synonyms: | CHEMBL2349192 | ||
Type | Small organic molecule | ||
Emp. Form. | C21H27ClN6O2 | ||
Mol. Mass. | 430.931 | ||
SMILES | CC(C)n1cnc2c(NCc3cc(Cl)ccc3O)nc(NC3CCC(O)CC3)nc12 |(10.04,-28.94,;11.08,-27.8,;12.58,-28.12,;10.6,-26.33,;11.51,-25.08,;10.6,-23.83,;9.13,-24.32,;7.79,-23.55,;7.78,-22.01,;9.12,-21.24,;9.11,-19.71,;10.43,-18.94,;10.41,-17.41,;11.74,-16.64,;9.08,-16.65,;7.76,-17.42,;7.77,-18.96,;6.45,-19.75,;6.47,-24.32,;6.47,-25.86,;5.12,-26.63,;5.12,-28.18,;3.78,-28.95,;3.77,-30.49,;5.11,-31.27,;5.1,-32.81,;6.45,-30.5,;6.46,-28.95,;7.79,-26.63,;9.13,-25.86,)| | ||
Structure |