Reaction Details Report a problem with these data
Target
Guanine nucleotide-binding protein G(q) subunit alpha
Ligand
BDBM50514449
Substrate
n/a
Meas. Tech.
ChEMBL_2100038 (CHEMBL4808434)
IC50
32±n/a nM
Citation
 Ge, Y; Shi, S; Deng, JJ; Chen, XP; Song, Z; Liu, L; Lou, L; Zhang, X; Xiong, XF Design, Synthesis, and Evaluation of Small Molecule G?q/11 Protein Inhibitors for the Treatment of Uveal Melanoma. J Med Chem 64:3131-3152 (2021) [PubMed]  Article 
Target
Name:
Guanine nucleotide-binding protein G(q) subunit alpha
Synonyms:
GAQ | GNAQ | GNAQ_HUMAN | Guanine nucleotide-binding protein G(q) subunit alpha | Guanine nucleotide-binding protein alpha-q
Type:
PROTEIN
Mol. Mass.:
42136.56
Organism:
Homo sapiens
Description:
ChEMBL_119337
Residue:
359
Sequence:
MTLESIMACCLSEEAKEARRINDEIERQLRRDKRDARRELKLLLLGTGESGKSTFIKQMRIIHGSGYSDEDKRGFTKLVYQNIFTAMQAMIRAMDTLKIPYKYEHNKAHAQLVREVDVEKVSAFENPYVDAIKSLWNDPGIQECYDRRREYQLSDSTKYYLNDLDRVADPAYLPTQQDVLRVRVPTTGIIEYPFDLQSVIFRMVDVGGQRSERRKWIHCFENVTSIMFLVALSEYDQVLVESDNENRMEESKALFRTIITYPWFQNSSVILFLNKKDLLEEKIMYSHLVDYFPEYDGPQRDAQAAREFILKMFVDLNPDSDKIIYSHFTCATDTENIRFVFAAVKDTILQLNLKEYNLV
  
Inhibitor
Name:
BDBM50514449
Synonyms:
CHEMBL4171381
Type:
Small organic molecule
Emp. Form.:
C49H75N7O15
Mol. Mass.:
1002.1577
SMILES:
CCC(=O)N[C@@H]([C@H](O)C(C)C)C(=O)O[C@H](C(C)C)[C@@H]1NC(=O)[C@H](C)N(C)C(=O)[C@H](C)NC(=O)C(=C)N(C)C(=O)[C@@H](Cc2ccccc2)OC(=O)[C@@H](NC(C)=O)[C@H](OC(=O)[C@H]([C@@H](C)OC)N(C)C1=O)C(C)C |r|
Structure:
Search PDB for entries with ligand similarity: