Reaction Details Report a problem with these data
Target
Corticotropin-releasing factor receptor 1
Ligand
BDBM50169506
Substrate
n/a
Meas. Tech.
ChEMBL_303113 (CHEMBL829622)
Ki
428.0±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:
BDBM50169506
Synonyms:
Benzyl-[2-trifluoromethyl-9-(2,4,6-trimethyl-phenyl)-9H-benzo[d]imidazo[1,2-a]imidazol-3-ylmethyl]-(3,3,3-trifluoro-propyl)-amine | CHEMBL187975
Type:
Small organic molecule
Emp. Form.:
C30H28F6N4
Mol. Mass.:
558.5605
SMILES:
Cc1cc(C)c(c(C)c1)-n1c2ccccc2n2c(CN(CCC(F)(F)F)Cc3ccccc3)c(nc12)C(F)(F)F |(5.53,-9.81,;4.46,-8.72,;2.97,-9.1,;1.9,-8,;.4,-8.39,;2.31,-6.53,;3.78,-6.14,;4.2,-4.65,;4.87,-7.23,;1.24,-5.44,;1.48,-3.92,;2.78,-3.08,;2.71,-1.55,;1.34,-.84,;.05,-1.66,;.12,-3.2,;-.99,-4.27,;-2.52,-4.51,;-3.6,-3.41,;-3.19,-1.92,;-1.7,-1.54,;-1.3,-.05,;-2.38,1.04,;-3.37,2.04,;-2.21,2.65,;-3.98,.9,;-4.27,-.82,;-5.76,-1.21,;-6.15,-2.69,;-7.64,-3.08,;-8.73,-1.98,;-8.31,-.5,;-6.83,-.1,;-2.77,-6.04,;-1.4,-6.74,;-.3,-5.66,;-4.16,-6.72,;-4.51,-8.28,;-5.41,-7.35,;-5.63,-6.06,)|
Structure:
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