Search and Browse
Download
Enter Data
| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Protein kinase C theta type | ||
| Ligand | BDBM50196987 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_453152 (CHEMBL902302) | ||
| IC50 | 13±n/a nM | ||
| Citation |  Cywin, CL; Dahmann, G; Prokopowicz, AS; Young, ER; Magolda, RL; Cardozo, MG; Cogan, DA; Disalvo, D; Ginn, JD; Kashem, MA; Wolak, JP; Homon, CA; Farrell, TM; Grbic, H; Hu, H; Kaplita, PV; Liu, LH; Spero, DM; Jeanfavre, DD; O'Shea, KM; White, DM; Woska, JR; Brown, ML Discovery of potent and selective PKC-theta inhibitors. Bioorg Med Chem Lett17:225-30 (2006) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Protein kinase C theta type | |||
| Name: | Protein kinase C theta type | ||
| Synonyms: | KPCT_HUMAN | PRKCQ | PRKCT | Protein kinase C theta | Protein kinase C theta type (PRKCQ) | Protein kinase C, PKC; classical/novel | nPKC-theta | ||
| Type: | Serine/threonine-protein kinase | ||
| Mol. Mass.: | 81878.04 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | Full-length human PKC theta (Panvera Catalog No. P2996). | ||
| Residue: | 706 | ||
| Sequence: |
| ||
| BDBM50196987 | |||
| n/a | |||
| Name | BDBM50196987 | ||
| Synonyms: | CHEMBL245912 | N2-(2,3-dimethylbenzyl)-N4-((4-(aminomethyl)cyclohexyl)methyl)-5-nitropyrimidine-2,4-diamine | ||
| Type | Small organic molecule | ||
| Emp. Form. | C21H30N6O2 | ||
| Mol. Mass. | 398.5019 | ||
| SMILES | Cc1cccc(CNc2ncc(c(NCC3CCC(CN)CC3)n2)[N+]([O-])=O)c1C |(20.87,-.91,;20.86,.63,;19.52,1.4,;19.52,2.95,;20.86,3.71,;22.19,2.94,;23.52,3.71,;24.86,2.94,;26.19,3.71,;26.19,5.25,;27.52,6.02,;28.86,5.26,;28.86,3.71,;30.2,2.94,;30.2,1.4,;31.53,.63,;31.53,-.9,;32.86,-1.67,;34.19,-.91,;35.53,-1.68,;35.52,-3.22,;34.2,.64,;32.86,1.41,;27.53,2.93,;30.19,6.03,;31.53,5.27,;30.19,7.58,;22.19,1.41,;23.53,.64,)| | ||
| Structure | 
| ||