Reaction Details Report a problem with these data
Target
GTPase KRas
Ligand
BDBM50587408
Substrate
n/a
Meas. Tech.
ChEMBL_2172534 (CHEMBL5057668)
IC50
20000±n/a nM
Citation
 Fumagalli, G; Carbajo, RJ; Nissink, JWM; Tart, J; Dou, R; Thomas, AP; Spring, DR Targeting a Novel KRAS Binding Site: Application of One-Component Stapling of Small (5-6-mer) Peptides. J Med Chem 64:17287-17303 (2021) [PubMed]  Article 
Target
Name:
GTPase KRas
Synonyms:
GTPase KRas, N-terminally processed | K-Ras 2 | KRAS | KRAS2 | Ki-Ras | RASK2 | RASK_HUMAN | c-K-ras | c-Ki-ras
Type:
PROTEIN
Mol. Mass.:
21656.10
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1476955
Residue:
189
Sequence:
MTEYKLVVVGAGGVGKSALTIQLIQNHFVDEYDPTIEDSYRKQVVIDGETCLLDILDTAGQEEYSAMRDQYMRTGEGFLCVFAINNTKSFEDIHHYREQIKRVKDSEDVPMVLVGNKCDLPSRTVDTKQAQDLARSYGIPFIETSAKTRQRVEDAFYTLVREIRQYRLKKISKEEKTPGCVKIKKCIIM
  
Inhibitor
Name:
BDBM50587408
Synonyms:
CHEMBL5077810
Type:
Small organic molecule
Emp. Form.:
C36H49N9O7
Mol. Mass.:
719.8304
SMILES:
CC(C)C[C@H](NC(=O)[C@@H]1COCc2cnnn2CCCCC(=O)NCC(=O)NC(C)(C)C(=O)N[C@@H](Cc2cccc3ccccc23)C(=O)N1)C(N)=O |r|
Structure:
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