Reaction Details Report a problem with these data
Target
Ras-related C3 botulinum toxin substrate 1
Ligand
BDBM54689
Substrate
n/a
Meas. Tech.
Additional SAR compounds tested via Multiplex dose response to identify specific small molecule inhibitors of Ras and Ras-related GTPases specifically Rac1 activated mutant
Ki
1060±n/a nM
Citation
 PubChem, PC Additional SAR compounds tested via Multiplex dose response to identify specific small molecule inhibitors of Ras and Ras-related GTPases specifically Rac1 activated mutant PubChem Bioassay (2009)[AID] 
Target
Name:
Ras-related C3 botulinum toxin substrate 1
Synonyms:
RAC1_MOUSE | Rac1 | Rac1 protein
Type:
PROTEIN
Mol. Mass.:
21455.91
Organism:
Mus musculus
Description:
EBI_101485
Residue:
192
Sequence:
MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL
  
Inhibitor
Name:
BDBM54689
Synonyms:
2-amino-5-benzoyl-4-(5-bromo-3-pyridinyl)-1-(4-methoxyphenyl)sulfonyl-3-pyrrolecarbonitrile | 2-amino-5-benzoyl-4-(5-bromo-3-pyridyl)-1-(4-methoxyphenyl)sulfonyl-pyrrole-3-carbonitrile | 2-amino-5-benzoyl-4-(5-bromopyridin-3-yl)-1-(4-methoxyphenyl)sulfonylpyrrole-3-carbonitrile | 2-azanyl-4-(5-bromanylpyridin-3-yl)-1-(4-methoxyphenyl)sulfonyl-5-(phenylcarbonyl)pyrrole-3-carbonitrile | UNM-0000305779 | cid_25220930
Type:
Small organic molecule
Emp. Form.:
C24H17BrN4O4S
Mol. Mass.:
537.385
SMILES:
COc1ccc(cc1)S(=O)(=O)n1c(N)c(C#N)c(c1C(=O)c1ccccc1)-c1cncc(Br)c1
Structure:
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