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Name | Mu-type opioid receptor |
---|---|
Species | Bos taurus (Bovine) |
Gene | OPRM1 |
Synonym | M-OR-1 MOR-1 |
Disease | N/A for non-human GPCRs |
Length | 401 |
Amino acid sequence | MDSGAVPTNASNCTDPFTHPSSCSPAPSPSSWVNFSHLEGNLSDPCGPNRTELGGSDRLCPSAGSPSMITAIIIMALYSIVCVVGLFGNFLVMYVIVRYTKMKTATNIYIFNLALADALATSTLPFQSVNYLMGTWPFGTILCKIVISIDYYNMFTSIFTLCTMSVDRYIAVCHPVKALDLRTPRNAKIINICNWILSSAIGLPVMFMATTKYRQGSIDCTLTFSHPTWYWENLLKICVFIFAFIMPILIITVCYGLMILRLKSVRMLSGSKEKDRNLRRITRMVLVVVAVFIVCWTPIHIYVIIKALITIPETTFQTVSWHFCIALGYTNSCLNPVLYAFLDENFKRCFREFCIPTSSTIEQQNSTRIRQNTRDHPSTANTVDRTNHQLENLEAETTPLP |
UniProt | P79350 |
Protein Data Bank | N/A |
GPCR-HGmod model | N/A |
3D structure model | No available structures or models |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL3041 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL41098 |
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Molecular formula | C38H42N4O8S2 |
IUPAC name | N-[(4R,4aS,7aR,12bR)-9-hydroxy-3-methyl-7-oxo-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-4a-yl]-2-[[2-[[(4R,4aS,7aR,12bR)-9-hydroxy-3-methyl-7-oxo-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-4a-yl]amino]-2-oxoethyl]disulfanyl]acetamide |
Molecular weight | 746.894 |
Hydrogen bond acceptor | 12 |
Hydrogen bond donor | 4 |
XlogP | 2.1 |
Synonyms | 14,14'-[Dithiobis(methylenecarbonylimino)]bis(3-hydroxy-4,5alpha-epoxy-17-methylmorphinan-6-one) bis-(1N-[10-hydroxy-4-methyl-14-oxo-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7,9,11(18)-trien-17-yl]-2-sulfanylacetamide ) BDBM50030143 |
Inchi Key | AJDLRTLLEAPIOA-ZQUSMLRHSA-N |
Inchi ID | InChI=1S/C38H42N4O8S2/c1-41-13-11-35-29-19-3-5-21(43)31(29)49-33(35)23(45)7-9-37(35,25(41)15-19)39-27(47)17-51-52-18-28(48)40-38-10-8-24(46)34-36(38)12-14-42(2)26(38)16-20-4-6-22(44)32(50-34)30(20)36/h3-6,25-26,33-34,43-44H,7-18H2,1-2H3,(H,39,47)(H,40,48)/t25-,26-,33+,34+,35+,36+,37-,38-/m1/s1 |
PubChem CID | 44287020 |
ChEMBL | CHEMBL41098 |
IUPHAR | N/A |
BindingDB | 50030143 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Activity | 25.0 - | PMID7515442 | ChEMBL |
IC50 | 0.4 nM | PMID7515442 | BindingDB |
IC50 | 0.4 nM | Bioorg. Med. Chem. Lett., (1995) 5:15:1695, PMID7515442 | ChEMBL |
IC50 | 0.4 nM | N/A | BindingDB |
Inhibition | 50.0 % | PMID7515442 | ChEMBL |
Inhibition | 78.0 % | PMID7515442 | ChEMBL |
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