Reaction Details Report a problem with these data
Target
Corticotropin-releasing factor receptor 1
Ligand
BDBM50169498
Substrate
n/a
Meas. Tech.
ChEMBL_303113 (CHEMBL829622)
Ki
53±n/a nM
Citation
 Han, X; Pin, SS; Burris, K; Fung, LK; Huang, S; Taber, MT; Zhang, J; Dubowchik, GM Synthesis and structure-activity relationship of imidazo[1,2-a]benzimidazoles as corticotropin-releasing factor 1 receptor antagonists. Bioorg Med Chem Lett 15:4029-32 (2005) [PubMed]  Article 
Target
Name:
Corticotropin-releasing factor receptor 1
Synonyms:
CRF-R | CRF-R2 Alpha | CRF1 | CRFR | CRFR1 | CRFR1_HUMAN | CRH-R 1 | CRHR | CRHR1 | Corticotropin releasing factor receptor 1 | Corticotropin-releasing factor receptor 1 (CRF-1) | Corticotropin-releasing factor receptor 1 (CRF1) | Corticotropin-releasing hormone receptor 1
Type:
Enzyme
Mol. Mass.:
50744.31
Organism:
Homo sapiens (Human)
Description:
P34998
Residue:
444
Sequence:
MGGHPQLRLVKALLLLGLNPVSASLQDQHCESLSLASNISGLQCNASVDLIGTCWPRSPAGQLVVRPCPAFFYGVRYNTTNNGYRECLANGSWAARVNYSECQEILNEEKKSKVHYHVAVIINYLGHCISLVALLVAFVLFLRLRPGCTHWGDQADGALEVGAPWSGAPFQVRRSIRCLRNIIHWNLISAFILRNATWFVVQLTMSPEVHQSNVGWCRLVTAAYNYFHVTNFFWMFGEGCYLHTAIVLTYSTDRLRKWMFICIGWGVPFPIIVAWAIGKLYYDNEKCWFGKRPGVYTDYIYQGPMILVLLINFIFLFNIVRILMTKLRASTTSETIQYRKAVKATLVLLPLLGITYMLFFVNPGEDEVSRVVFIYFNSFLESFQGFFVSVFYCFLNSEVRSAIRKRWHRWQDKHSIRARVARAMSIPTSPTRVSFHSIKQSTAV
  
Inhibitor
Name:
BDBM50169498
Synonyms:
CHEMBL191052 | Cyclobutylmethyl-(2,2,2-trifluoro-ethyl)-[2-trifluoromethyl-9-(2,4,6-trimethyl-phenyl)-9H-benzo[d]imidazo[1,2-a]imidazol-3-ylmethyl]-amine
Type:
Small organic molecule
Emp. Form.:
C27H28F6N4
Mol. Mass.:
522.5284
SMILES:
Cc1cc(C)c(c(C)c1)-n1c2ccccc2n2c(CN(CC3CCC3)CC(F)(F)F)c(nc12)C(F)(F)F |(6.59,-23.74,;5.51,-22.63,;4.01,-23.02,;2.94,-21.93,;1.45,-22.32,;3.36,-20.45,;4.85,-20.06,;5.25,-18.57,;5.92,-21.15,;2.29,-19.36,;2.54,-17.84,;3.83,-17.01,;3.76,-15.48,;2.38,-14.77,;1.1,-15.59,;1.17,-17.13,;.07,-18.2,;-1.46,-18.43,;-2.54,-17.34,;-2.14,-15.85,;-.64,-15.47,;-.25,-13.98,;-1,-12.66,;.33,-11.89,;1.09,-13.23,;-3.21,-14.75,;-2.81,-13.26,;-2.42,-11.91,;-3.73,-11.96,;-1.48,-14.03,;-1.72,-19.96,;-.34,-20.67,;.75,-19.59,;-3.1,-20.65,;-4.57,-19.99,;-3.46,-22.21,;-4.35,-21.28,)|
Structure:
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