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TargetCytochrome P450 2D6
LigandBDBM50344259
Substrate/Competitorn/a
Meas. Tech.ChEMBL_748234 (CHEMBL1781197)
IC50>20000±n/a nM
Citation Brown, DGMaier, DLSylvester, MAHoerter, TNMenhaji-Klotz, ELasota, CCHirata, LTWilkins, DEScott, CWTrivedi, SChen, TMcCarthy, DJMaciag, CMSutton, EJCumberledge, JMathisen, DRoberts, JGupta, ALiu, FElmore, CSAlhambra, CKrumrine, JRWang, XCiaccio, PJWood, MWCampbell, JBJohansson, MJXia, JWen, XJiang, JWang, XPeng, ZHu, TWang, J 2,6-Disubstituted pyrazines and related analogs as NR2B site antagonists of the NMDA receptor with anti-depressant activity. Bioorg Med Chem Lett21:3399-403 (2011) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Cytochrome P450 2D6
Name:Cytochrome P450 2D6
Synonyms:CP2D6_HUMAN | CYP2D6 | CYP2DL1 | CYPIID6 | Cytochrome P450 2D6 (CYP2D6) | Debrisoquine 4-hydroxylase | P450-DB1
Type:Protein
Mol. Mass.:55774.82
Organism:Homo sapiens (Human)
Description:P10635
Residue:497
Sequence:
MGLEALVPLAVIVAIFLLLVDLMHRRQRWAARYPPGPLPLPGLGNLLHVDFQNTPYCFDQ
LRRRFGDVFSLQLAWTPVVVLNGLAAVREALVTHGEDTADRPPVPITQILGFGPRSQGVF
LARYGPAWREQRRFSVSTLRNLGLGKKSLEQWVTEEAACLCAAFANHSGRPFRPNGLLDK
AVSNVIASLTCGRRFEYDDPRFLRLLDLAQEGLKEESGFLREVLNAVPVLLHIPALAGKV
LRFQKAFLTQLDELLTEHRMTWDPAQPPRDLTEAFLAEMEKAKGNPESSFNDENLRIVVA
DLFSAGMVTTSTTLAWGLLLMILHPDVQRRVQQEIDDVIGQVRRPEMGDQAHMPYTTAVI
HEVQRFGDIVPLGVTHMTSRDIEVQGFRIPKGTTLITNLSSVLKDEAVWEKPFRFHPEHF
LDAQGHFVKPEAFLPFSAGRRACLGEPLARMELFLFFTSLLQHFSFSVPTGQPRPSHHGV
FAFLVSPSPYELCAVPR
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50344259
n/a
NameBDBM50344259
Synonyms:CHEMBL1779012 | N-((5-(4-fluoro-2-methoxyphenyl)pyridin-3-yl)methyl)pyrazine-2-carboxamide
TypeSmall organic molecule
Emp. Form.C18H15FN4O2
Mol. Mass.338.3357
SMILESCOc1cc(F)ccc1-c1cncc(CNC(=O)c2cnccn2)c1
Structure
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