Reaction Details |
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Target | GTPase KRas |
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Ligand | BDBM50579095 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_2134567 (CHEMBL4844177) |
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Kd | 230±n/a nM |
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Citation | Buyanova, M; Cai, S; Cooper, J; Rhodes, C; Salim, H; Sahni, A; Upadhyaya, P; Yang, R; Sarkar, A; Li, N; Wang, QE; Pei, D Discovery of a Bicyclic Peptidyl Pan-Ras Inhibitor. J Med Chem64:13038-13053 (2021) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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GTPase KRas |
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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: | MTEYKLVVVGAGGVGKSALTIQLIQNHFVDEYDPTIEDSYRKQVVIDGETCLLDILDTAG
QEEYSAMRDQYMRTGEGFLCVFAINNTKSFEDIHHYREQIKRVKDSEDVPMVLVGNKCDL
PSRTVDTKQAQDLARSYGIPFIETSAKTRQRVEDAFYTLVREIRQYRLKKISKEEKTPGC
VKIKKCIIM
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BDBM50579095 |
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n/a |
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Name | BDBM50579095 |
Synonyms: | CHEMBL4851139 |
Type | Small organic molecule |
Emp. Form. | C108H138N30O21 |
Mol. Mass. | 2192.4397 |
SMILES | C[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCN)NC(=O)[C@@H]1CNC(=O)c2cc3cc(c2)C(=O)N[C@H](Cc2ccc4ccccc4c2)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](Cc2ccc4ccccc4c2)C(=O)N[C@@H](c2ccccc2)C(=O)N[C@@H](CCCCNC3=O)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1)C(N)=O |r| |
Structure |
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