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Target
Corticotropin-releasing factor receptor 1
Ligand
BDBM50203595
Substrate
n/a
Meas. Tech.
ChEMBL_454261 (CHEMBL903444)
Ki
5600±n/a nM
Citation
 Han, X; Civiello, R; Pin, SS; Burris, K; Balanda, LA; Knipe, J; Ren, S; Fiedler, T; Browman, KE; Macci, R; Taber, MT; Zhang, J; Dubowchik, GM An orally active corticotropin releasing factor 1 receptor antagonist from 8-aryl-1,3a,7,8-tetraaza-cyclopenta[a]indenes. Bioorg Med Chem Lett 17:2026-30 (2007) [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:
BDBM50203595
Synonyms:
CHEMBL245506 | [8-(2-chloro-4,6-dimethyl-phenyl)-2-methyl-8H-1,3a,7,8-tetraaza-cyclopenta[a]inden-3-ylmethyl]-(2-methoxy-1-methoxymethyl-ethyl)-amine
Type:
Small organic molecule
Emp. Form.:
C23H28ClN5O2
Mol. Mass.:
441.954
SMILES:
COCC(COC)NCc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(14.24,-12.4,;13.71,-13.85,;14.7,-15.03,;14.18,-16.48,;12.66,-16.75,;11.67,-15.57,;10.16,-15.84,;15.17,-17.66,;14.65,-19.1,;15.64,-20.28,;15.27,-21.78,;13.85,-22.35,;16.58,-22.59,;17.76,-21.6,;19.3,-21.49,;20.29,-22.67,;21.79,-22.4,;22.32,-20.95,;22.78,-23.58,;22.26,-25.03,;23.25,-26.21,;20.74,-25.3,;19.75,-24.12,;18.23,-24.38,;19.67,-20,;21.04,-19.28,;21.1,-17.73,;19.72,-16.84,;18.41,-17.64,;18.36,-19.18,;17.18,-20.17,)|
Structure:
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