Reaction Details Report a problem with these data
Target
Corticotropin-releasing factor receptor 1
Ligand
BDBM50148904
Substrate
n/a
Meas. Tech.
ChEBML_51104
Ki
8.6±n/a nM
Citation
 Chen, C; Wilcoxen, KM; Huang, CQ; McCarthy, JR; Chen, T; Grigoriadis, DE Optimization of 3-phenylpyrazolo[1,5-a]pyrimidines as potent corticotropin-releasing factor-1 antagonists with adequate lipophilicity and water solubility. Bioorg Med Chem Lett 14:3669-73 (2004) [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:
BDBM50148904
Synonyms:
CHEMBL122960 | Cyclopropylmethyl-[3-(2,4-dichloro-phenyl)-5-methanesulfinyl-2-methyl-3H-pyrazolo[1,5-a]pyrimidin-7-yl]-propyl-amine
Type:
Small organic molecule
Emp. Form.:
C21H24Cl2N4OS
Mol. Mass.:
451.412
SMILES:
CCCN(CC1CC1)c1cc(nc2c(c(C)nn12)-c1ccc(Cl)cc1Cl)S(C)=O |(9.67,-6.94,;9.62,-8.48,;10.93,-9.29,;10.89,-10.82,;12.19,-11.62,;12.15,-13.16,;13.47,-13.96,;11.06,-14.25,;9.55,-11.55,;9.5,-13.08,;8.13,-13.83,;6.83,-13.02,;6.87,-11.48,;5.75,-10.42,;6.43,-9.03,;5.71,-7.67,;7.97,-9.24,;8.24,-10.74,;4.27,-10.68,;3.75,-12.12,;2.24,-12.39,;1.25,-11.21,;-.24,-11.62,;1.76,-9.78,;3.27,-9.51,;4.04,-8.17,;8.08,-15.36,;9.4,-16.18,;6.73,-16.09,)|
Structure:
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