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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | GTPase KRas [G12C] | ||
| Ligand | BDBM608994 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | Scintillation Proximity Assay (SPA) | ||
| IC50 | 30.0±n/a nM | ||
| Citation |  Cotesta, S; Gerspacher, M; Leblanc, C; Lorthiois, EL; Liu, B; Machauer, R; Mah, R; Mura, C; Rigollier, P; Schneider, N; Stutz, S; Vaupel, A; Warin, N; Wilcken, R Pyrazolyl derivatives useful as anti-cancer agents US Patent US11702409 Publication Date 7/18/2023 | ||
| More Info.: | Get all data from this article, Assay Method | ||
| GTPase KRas [G12C] | |||
| Name: | GTPase KRas [G12C] | ||
| Synonyms: | GTPase KRas (G12C) | KRAS | KRAS2 | RASK2 | RASK_HUMAN | ||
| Type: | Enzyme Catalytic Domain | ||
| Mol. Mass.: | 21702.19 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P01116[G12C] | ||
| Residue: | 189 | ||
| Sequence: |
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| BDBM608994 | |||
| n/a | |||
| Name | BDBM608994 | ||
| Synonyms: | US11702409, Example 70a | US11702409, Example 70b | ||
| Type | Small organic molecule | ||
| Emp. Form. | C27H27ClN6O | ||
| Mol. Mass. | 486.996 | ||
| SMILES | Cc1c(c(nn1C1CC2(C1)CN(C2)C(=O)C=C)-c1ccccc1)-c1c(Cl)c(C)cc2[nH]nc(N)c12 |(-2.19,-2.79,;-.73,-2.31,;.52,-3.21,;1.77,-2.31,;1.29,-.84,;-.25,-.84,;-1.15,.4,;-.91,1.92,;-2.43,2.16,;-2.68,.64,;-2.19,3.68,;-3.72,3.93,;-3.96,2.4,;-4.62,5.17,;-6.16,5.17,;-3.92,6.54,;-4.76,7.83,;3.23,-2.79,;3.55,-4.29,;5.02,-4.77,;6.16,-3.74,;5.84,-2.23,;4.38,-1.75,;.52,-4.75,;1.85,-5.52,;3.34,-5.13,;1.85,-7.06,;3.19,-7.83,;.52,-7.83,;-.81,-7.06,;-2.28,-7.54,;-3.18,-6.29,;-2.28,-5.05,;-2.75,-3.58,;-.81,-5.52,)| | ||
| Structure | 
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