Reaction Details Report a problem with these data
Target
Corticotropin-releasing factor receptor 1
Ligand
BDBM50169518
Substrate
n/a
Meas. Tech.
ChEMBL_303113 (CHEMBL829622)
Ki
291±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:
BDBM50169518
Synonyms:
(2,2,2-Trifluoro-ethyl)-[2-trifluoromethyl-9-(2,4,6-trimethyl-phenyl)-9H-benzo[d]imidazo[1,2-a]imidazol-3-ylmethyl]-(3,3,3-trifluoro-propyl)-amine | CHEMBL190638
Type:
Small organic molecule
Emp. Form.:
C25H23F9N4
Mol. Mass.:
550.4625
SMILES:
Cc1cc(C)c(c(C)c1)-n1c2ccccc2n2c(CN(CCC(F)(F)F)CC(F)(F)F)c(nc12)C(F)(F)F |(4.95,-9.78,;3.86,-8.68,;4.27,-7.19,;3.2,-6.11,;3.6,-4.62,;1.71,-6.49,;1.31,-7.98,;-.19,-8.36,;2.38,-9.08,;.64,-5.41,;.89,-3.88,;2.19,-3.05,;2.12,-1.52,;.75,-.8,;-.55,-1.64,;-.48,-3.17,;-1.58,-4.25,;-3.12,-4.48,;-4.19,-3.38,;-3.78,-1.9,;-4.87,-.79,;-4.45,.69,;-5.53,1.79,;-6.51,2.79,;-5.36,3.4,;-7.13,1.65,;-2.3,-1.5,;-1.89,-.02,;-1.52,1.33,;-.41,.63,;-2.81,1.3,;-3.37,-6,;-2,-6.72,;-.89,-5.63,;-4.75,-6.69,;-6.01,-7.32,;-6.22,-6.02,;-5.11,-8.26,)|
Structure:
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