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Name | Melanocortin receptor 5 |
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Species | Homo sapiens (Human) |
Gene | MC5R |
Synonym | melanocortin receptor 5 MC5R MC5-R MC5 receptor MC-2 |
Disease | Acne vulgaris Seborrhea |
Length | 325 |
Amino acid sequence | MNSSFHLHFLDLNLNATEGNLSGPNVKNKSSPCEDMGIAVEVFLTLGVISLLENILVIGAIVKNKNLHSPMYFFVCSLAVADMLVSMSSAWETITIYLLNNKHLVIADAFVRHIDNVFDSMICISVVASMCSLLAIAVDRYVTIFYALRYHHIMTARRSGAIIAGIWAFCTGCGIVFILYSESTYVILCLISMFFAMLFLLVSLYIHMFLLARTHVKRIAALPGASSARQRTSMQGAVTVTMLLGVFTVCWAPFFLHLTLMLSCPQNLYCSRFMSHFNMYLILIMCNSVMDPLIYAFRSQEMRKTFKEIICCRGFRIACSFPRRD |
UniProt | P33032 |
Protein Data Bank | N/A |
GPCR-HGmod model | P33032 |
3D structure model | This predicted structure model is from GPCR-EXP P33032. |
BioLiP | N/A |
Therapeutic Target Database | T95302 |
ChEMBL | CHEMBL4608 |
IUPHAR | 286 |
DrugBank | N/A |
Name | SCHEMBL2344437 |
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Molecular formula | C35H40N6O2 |
IUPAC name | N-[[(3R,5R)-3-[3-(diaminomethylideneamino)propyl]-1-(2,2-diphenylethyl)-2-oxo-1,4-diazepan-5-yl]methyl]naphthalene-2-carboxamide |
Molecular weight | 576.745 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 4 |
XlogP | 4.4 |
Synonyms | US9340517, 105 CHEMBL3975851 BDBM230656 |
Inchi Key | DKFQXTHTGAKMJQ-XLJNKUFUSA-N |
Inchi ID | InChI=1S/C35H40N6O2/c36-35(37)38-20-9-16-32-34(43)41(24-31(26-11-3-1-4-12-26)27-13-5-2-6-14-27)21-19-30(40-32)23-39-33(42)29-18-17-25-10-7-8-15-28(25)22-29/h1-8,10-15,17-18,22,30-32,40H,9,16,19-21,23-24H2,(H,39,42)(H4,36,37,38)/t30-,32-/m1/s1 |
PubChem CID | 57854192 |
ChEMBL | CHEMBL3975851 |
IUPHAR | N/A |
BindingDB | 230656 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 56.0 nM | , None | BindingDB,ChEMBL |
IC50 | 57.0 nM | , None | BindingDB,ChEMBL |
IC50 | >100.0 nM | , None | BindingDB,ChEMBL |
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