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Target
GTPase KRas [2-169,G12C]/Son of sevenless homolog 1 [564-1049]
Ligand
BDBM581997
Substrate
n/a
Meas. Tech.
KRAS/SOS1 nucleotide exchange HTRF Assay
IC50
<15±n/a nM
Citation
 Babu, BS; Kumar, SR; Cho-Hua, LC; Igor, M; Duane, BK; Qinhua, HP; Mohammad, A TRICYCLIC COMPOUNDS WIPO 0:0 (2023) [PubMed] 
Target
Name:
GTPase KRas [2-169,G12C]/Son of sevenless homolog 1 [564-1049]
Synonyms:
KRAS/SOS1
Type:
Protein
Mol. Mass.:
n/a
Description:
n/a
Components:
This complex has 2 components.
Component 1
Name:
GTPase KRas [2-169,G12C]
Synonyms:
KRAS | KRAS2 | RASK2 | RASK_HUMAN
Type:
Enzyme Catalytic Domain
Mol. Mass.:
19308.11
Organism:
Homo sapiens (Human)
Description:
P01116[2-169,G12C]
Residue:
168
Sequence:
TEYKLVVVGACGVGKSALTIQLIQNHFVDEYDPTIEDSYRKQVVIDGETCLLDILDTAGQEEYSAMRDQYMRTGEGFLCVFAINNTKSFEDIHHYREQIKRVKDSEDVPMVLVGNKCDLPSRTVDTKQAQDLARSYGIPFIETSAKTRQRVEDAFYTLVREIRQYRLK
  
Component 2
Name:
Son of sevenless homolog 1 [564-1049]
Synonyms:
SOS1 | SOS1_HUMAN | Son of sevenless homolog 1 (SOS1)(564-1049)
Type:
Enzyme Catalytic Domain
Mol. Mass.:
56970.22
Organism:
n/a
Description:
aa 564-1049
Residue:
486
Sequence:
EEQMRLPSADVYRFAEPDSEENIIFEENMQPKAGIPIIKAGTVIKLIERLTYHMYADPNFVRTFLTTYRSFCKPQELLSLIIERFEIPEPEPTEADRIAIENGDQPLSAELKRFRKEYIQPVQLRVLNVCRHWVEHHFYDFERDAYLLQRMEEFIGTVRGKAMKKWVESITKIIQRKKIARDNGPGHNITFQSSPPTVEWHISRPGHIETFDLLTLHPIEIARQLTLLESDLYRAVQPSELVGSVWTKEDKEINSPNLLKMIRHTTNLTLWFEKCIVETENLEERVAVVSRIIEILQVFQELNNFNGVLEVVSAMNSSPVYRLDHTFEQIPSRQKKILEEAHELSEDHYKKYLAKLRSINPPCVPFFGIYLTNILKTEEGNPEVLKRHGKELINFSKRRKVAEITGEIQQYQNQPYCLRVESDIKRFFENLNPMGNSMEKEFTDYLFNKSLEIEPRNPKPLPRFPKKYSYPLKSPGVRPSNPRPGT
 
Inhibitor
Name:
BDBM581997
Synonyms:
WO2023287730, Compound P172-2.1
Type:
Small organic molecule
Emp. Form.:
C25H23F3N4O
Mol. Mass.:
452.4715
SMILES:
C[C@@H](Nc1nc2nccn2c2ccc(cc12)C1=CCOCC1)c1cccc(c1C)C(F)(F)F |r,t:19|
Structure:
Search PDB for entries with ligand similarity: