Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetOxytocin receptor
LigandBDBM50305516
Substrate/Competitorn/a
Meas. Tech.ChEMBL_604218 (CHEMBL1050363)
Ki 28.5±n/a nM
Citation Brown, ABrown, TBCalabrese, AEllis, DPuhalo, NRalph, MWatson, L Triazole oxytocin antagonists: Identification of an aryloxyazetidine replacement for a biaryl substituent. Bioorg Med Chem Lett20:516-20 (2010) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Oxytocin receptor
Name:Oxytocin receptor
Synonyms:OT-R | OXTR | OXYR_HUMAN | Oxytocin
Type:Enzyme Catalytic Domain
Mol. Mass.:42793.26
Organism:Homo sapiens (Human)
Description:Oxytocin OXTR HEK293::B2R9L7
Residue:389
Sequence:
MEGALAANWSAEAANASAAPPGAEGNRTAGPPRRNEALARVEVAVLCLILLLALSGNACV
LLALRTTRQKHSRLFFFMKHLSIADLVVAVFQVLPQLLWDITFRFYGPDLLCRLVKYLQV
VGMFASTYLLLLMSLDRCLAICQPLRSLRRRTDRLAVLATWLGCLVASAPQVHIFSLREV
ADGVFDCWAVFIQPWGPKAYITWITLAVYIVPVIVLAACYGLISFKIWQNLRLKTAAAAA
AEAPEGAAAGDGGRVALARVSSVKLISKAKIRTVKMTFIIVLAFIVCWTPFFFVQMWSVW
DANAPKEASAFIIVMLLASLNSCCNPWIYMLFTGHLFHELVQRFLCCSASYLKGRRLGET
SASKKSNSSSFVLSHRSSSQRSCSQPSTA
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50305516
n/a
NameBDBM50305516
Synonyms:(R)-2-methoxy-5-(3-(methoxymethyl)-5-(3-(o-tolyloxy)pyrrolidin-1-yl)-4H-1,2,4-triazol-4-yl)pyridine | CHEMBL590097
TypeSmall organic molecule
Emp. Form.C21H25N5O3
Mol. Mass.395.4549
SMILESCOCc1nnc(N2CC[C@H](C2)Oc2ccccc2C)n1-c1ccc(OC)nc1 |r|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: