You can:
Name | Oxytocin receptor |
---|---|
Species | Homo sapiens (Human) |
Gene | OXTR |
Synonym | OTR OT-R OT receptor |
Disease | Threatened pre-term labour Postpartum haemorrhage Premature ejaculation Miscarriage Female sexual dysfunction [ Show all ] |
Length | 389 |
Amino acid sequence | MEGALAANWSAEAANASAAPPGAEGNRTAGPPRRNEALARVEVAVLCLILLLALSGNACVLLALRTTRQKHSRLFFFMKHLSIADLVVAVFQVLPQLLWDITFRFYGPDLLCRLVKYLQVVGMFASTYLLLLMSLDRCLAICQPLRSLRRRTDRLAVLATWLGCLVASAPQVHIFSLREVADGVFDCWAVFIQPWGPKAYITWITLAVYIVPVIVLAACYGLISFKIWQNLRLKTAAAAAAEAPEGAAAGDGGRVALARVSSVKLISKAKIRTVKMTFIIVLAFIVCWTPFFFVQMWSVWDANAPKEASAFIIVMLLASLNSCCNPWIYMLFTGHLFHELVQRFLCCSASYLKGRRLGETSASKKSNSSSFVLSHRSSSQRSCSQPSTA |
UniProt | P30559 |
Protein Data Bank | N/A |
GPCR-HGmod model | P30559 |
3D structure model | This predicted structure model is from GPCR-EXP P30559. |
BioLiP | N/A |
Therapeutic Target Database | T84486 |
ChEMBL | CHEMBL2049 |
IUPHAR | 369 |
DrugBank | BE0000844 |
Name | BDBM81891 |
---|---|
Molecular formula | C42H56N8O6 |
IUPAC name | 2-amino-N-[1-[1-[2-amino-3-[2,2-bis(piperidine-1-carbonyl)imidazol-4-yl]propanoyl]-2-formylpyrrolidin-2-yl]-3-methyl-1-oxopentan-2-yl]-3-naphthalen-2-ylpropanamide |
Molecular weight | 768.96 |
Hydrogen bond acceptor | 10 |
Hydrogen bond donor | 3 |
XlogP | 2.2 |
Synonyms | CAS_188397 NSC_188397 |
Inchi Key | OCVKQRQVXSMCCJ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C42H56N8O6/c1-3-28(2)35(46-37(53)33(43)24-29-15-16-30-13-6-7-14-31(30)23-29)36(52)41(27-51)17-12-22-50(41)38(54)34(44)25-32-26-45-42(47-32,39(55)48-18-8-4-9-19-48)40(56)49-20-10-5-11-21-49/h6-7,13-16,23,26-28,33-35H,3-5,8-12,17-22,24-25,43-44H2,1-2H3,(H,46,53) |
PubChem CID | 53463360 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 81891 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 5.1 nM | PMID1988661 | PDSP,BindingDB |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417