Reaction Details Report a problem with these data
Target
Transforming protein RhoA
Ligand
BDBM50347736
Substrate
n/a
Meas. Tech.
ChEMBL_756282 (CHEMBL1805095)
IC50
2580±n/a nM
Citation
 Deng, J; Feng, E; Ma, S; Zhang, Y; Liu, X; Li, H; Huang, H; Zhu, J; Zhu, W; Shen, X; Miao, L; Liu, H; Jiang, H; Li, J Design and synthesis of small molecule RhoA inhibitors: a new promising therapy for cardiovascular diseases? J Med Chem 54:4508-22 (2011) [PubMed]  Article 
Target
Name:
Transforming protein RhoA
Synonyms:
ARH12 | ARHA | RHO12 | RHOA | RHOA_HUMAN | Rho cDNA clone 12 | h12
Type:
PROTEIN
Mol. Mass.:
21766.89
Organism:
Homo sapiens (Human)
Description:
ChEMBL_966397
Residue:
193
Sequence:
MAAIRKKLVIVGDGACGKTCLLIVFSKDQFPEVYVPTVFENYVADIEVDGKQVELALWDTAGQEDYDRLRPLSYPDTDVILMCFSIDSPDSLENIPEKWTPEVKHFCPNVPIILVGNKKDLRNDEHTRRELAKMKQEPVKPEEGRDMANRIGAFGYMECSAKTKDGVREVFEMATRAALQARRGKKKSGCLVL
  
Inhibitor
Name:
BDBM50347736
Synonyms:
CHEMBL1802525
Type:
Small organic molecule
Emp. Form.:
C26H19N5O6
Mol. Mass.:
497.459
SMILES:
OC(=O)\C=C\c1ccc(Nc2nc3ccc(cc3nc2Nc2ccc(\C=C\C(O)=O)cc2)[N+]([O-])=O)cc1
Structure:
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