Reaction Details Report a problem with these data
Target
Corticotropin-releasing factor receptor 1
Ligand
BDBM50169516
Substrate
n/a
Meas. Tech.
ChEMBL_303113 (CHEMBL829622)
Ki
618±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:
BDBM50169516
Synonyms:
CHEMBL365858 | Phenethyl-[2-trifluoromethyl-9-(2,4,6-trimethyl-phenyl)-9H-benzo[d]imidazo[1,2-a]imidazol-3-ylmethyl]-(3,3,3-trifluoro-propyl)-amine
Type:
Small organic molecule
Emp. Form.:
C31H30F6N4
Mol. Mass.:
572.5871
SMILES:
Cc1cc(C)c(c(C)c1)-n1c2ccccc2n2c(CN(CCc3ccccc3)CCC(F)(F)F)c(nc12)C(F)(F)F |(4.09,-8.17,;3.02,-7.07,;1.52,-7.46,;.45,-6.37,;-1.04,-6.75,;.87,-4.88,;2.36,-4.48,;2.76,-3.01,;3.44,-5.58,;-.2,-3.79,;.05,-2.27,;1.34,-1.43,;1.27,.11,;-.11,.81,;-1.39,-.02,;-1.32,-1.55,;-2.42,-2.63,;-3.96,-2.85,;-5.04,-1.76,;-4.63,-.28,;-5.71,.83,;-7.2,.44,;-8.28,1.53,;-9.76,1.14,;-10.84,2.23,;-10.44,3.72,;-8.95,4.12,;-7.87,3.02,;-3.14,.11,;-2.74,1.6,;-3.82,2.7,;-4.8,3.7,;-3.65,4.29,;-5.43,2.54,;-4.21,-4.39,;-2.84,-5.11,;-1.74,-4.02,;-5.6,-5.07,;-5.96,-6.65,;-6.85,-5.7,;-7.07,-4.41,)|
Structure:
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