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Name | Melanocortin receptor 4 |
---|---|
Species | Mus musculus (Mouse) |
Gene | Mc4r |
Synonym | MC4 receptor MC4-R |
Disease | N/A for non-human GPCRs |
Length | 332 |
Amino acid sequence | MNSTHHHGMYTSLHLWNRSSYGLHGNASESLGKGHPDGGCYEQLFVSPEVFVTLGVISLLENILVIVAIAKNKNLHSPMYFFICSLAVADMLVSVSNGSETIVITLLNSTDTDAQSFTVNIDNVIDSVICSSLLASICSLLSIAVDRYFTIFYALQYHNIMTVRRVGIIISCIWAACTVSGVLFIIYSDSSAVIICLISMFFTMLVLMASLYVHMFLMARLHIKRIAVLPGTGTIRQGTNMKGAITLTILIGVFVVCWAPFFLHLLFYISCPQNPYCVCFMSHFNLYLILIMCNAVIDPLIYALRSQELRKTFKEIICFYPLGGICELSSRY |
UniProt | P56450 |
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 | CHEMBL3719 |
IUPHAR | N/A |
DrugBank | N/A |
Name | BDBM50427692 |
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Molecular formula | C80H96N18O15S3 |
IUPAC name | (2S,5S,8S,11S,14R,19R,22S,25R,28S,34S)-N-[(2S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-19-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-(2-amino-2-oxoethyl)-11,22,25-tribenzyl-34-[3-(diaminomethylideneamino)propyl]-2-(1H-indol-3-ylmethyl)-8-methyl-3,6,9,12,20,23,26,32,36-nonaoxo-16,17,30-trithia-1,4,7,10,13,21,24,27,35-nonazabicyclo[26.4.4]hexatriacontane-14-carboxamide |
Molecular weight | 1645.94 |
Hydrogen bond acceptor | 20 |
Hydrogen bond donor | 18 |
XlogP | 2.1 |
Synonyms | N/A |
Inchi Key | GZWGEWCWRAMJIB-TWLSXMBOSA-N |
Inchi ID | InChI=1S/C80H96N18O15S3/c1-45-70(104)91-59(34-46-14-5-2-6-15-46)74(108)97-65(77(111)90-58(69(83)103)33-50-25-29-54(100)30-26-50)43-116-115-42-64(95-71(105)56(81)32-49-23-27-53(99)28-24-49)78(112)93-60(35-47-16-7-3-8-17-47)73(107)92-61(36-48-18-9-4-10-19-48)75(109)96-63-41-114-44-68(102)98(40-52(89-76(63)110)20-13-31-86-80(84)85)66(37-51-39-87-57-22-12-11-21-55(51)57)79(113)94-62(38-67(82)101)72(106)88-45/h2-12,14-19,21-30,39,45,52,56,58-66,87,99-100H,13,20,31-38,40-44,81H2,1H3,(H2,82,101)(H2,83,103)(H,88,106)(H,89,110)(H,90,111)(H,91,104)(H,92,107)(H,93,112)(H,94,113)(H,95,105)(H,96,109)(H,97,108)(H4,84,85,86)/t45-,52-,56-,58-,59-,60-,61+,62-,63+,64-,65-,66-/m0/s1 |
PubChem CID | 91899989 |
ChEMBL | CHEMBL2323789 |
IUPHAR | N/A |
BindingDB | 50427692 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 290.0 nM | PMID23432160 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218