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Name | Melanocortin receptor 3 |
---|---|
Species | Homo sapiens (Human) |
Gene | MC3R |
Synonym | MC3-R melanocortin receptor 3 MC3 receptor gamma-MSH receptor |
Disease | Sexual dysfunction; Obesity; Type 2 diabetes |
Length | 323 |
Amino acid sequence | MNASCCLPSVQPTLPNGSEHLQAPFFSNQSSSAFCEQVFIKPEVFLSLGIVSLLENILVILAVVRNGNLHSPMYFFLCSLAVADMLVSVSNALETIMIAIVHSDYLTFEDQFIQHMDNIFDSMICISLVASICNLLAIAVDRYVTIFYALRYHSIMTVRKALTLIVAIWVCCGVCGVVFIVYSESKMVIVCLITMFFAMMLLMGTLYVHMFLFARLHVKRIAALPPADGVAPQQHSCMKGAVTITILLGVFIFCWAPFFLHLVLIITCPTNPYCICYTAHFNTYLVLIMCNSVIDPLIYAFRSLELRNTFREILCGCNGMNLG |
UniProt | P41968 |
Protein Data Bank | N/A |
GPCR-HGmod model | P41968 |
3D structure model | This predicted structure model is from GPCR-EXP P41968. |
BioLiP | N/A |
Therapeutic Target Database | T76846 |
ChEMBL | CHEMBL4644 |
IUPHAR | 284 |
DrugBank | N/A |
Name | CHEMBL314401 |
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Molecular formula | C46H55N13O7 |
IUPAC name | (4S,7R,10S,13R,16R)-7-benzyl-10-[3-(diaminomethylideneamino)propyl]-4-(1H-imidazol-5-ylmethyl)-13-(1H-indol-3-ylmethyl)-2,5,8,11,14,22-hexaoxo-3,6,9,12,15,21-hexazabicyclo[21.4.0]heptacosa-1(27),23,25-triene-16-carboxamide |
Molecular weight | 902.03 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 11 |
XlogP | 1.2 |
Synonyms | BDBM50114085 (O)C-(C6H4)-C(O)-c[His-D-Phe-Arg-Trp-Lys]-NH2) (MK-6) |
Inchi Key | CCSNUTWWOMOIBR-GSPXPSQGSA-N |
Inchi ID | InChI=1S/C46H55N13O7/c47-39(60)34-17-8-9-19-51-40(61)31-14-4-5-15-32(31)41(62)57-38(23-29-25-50-26-54-29)45(66)58-36(21-27-11-2-1-3-12-27)43(64)56-35(18-10-20-52-46(48)49)42(63)59-37(44(65)55-34)22-28-24-53-33-16-7-6-13-30(28)33/h1-7,11-16,24-26,34-38,53H,8-10,17-23H2,(H2,47,60)(H,50,54)(H,51,61)(H,55,65)(H,56,64)(H,57,62)(H,58,66)(H,59,63)(H4,48,49,52)/t34-,35+,36-,37-,38+/m1/s1 |
PubChem CID | 44323233 |
ChEMBL | CHEMBL314401 |
IUPHAR | N/A |
BindingDB | 50114085 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
ACT | 76.0 % | PMID12036373 | ChEMBL |
EC50 | 13.0 nM | PMID12036373 | BindingDB,ChEMBL |
Ki | 280.0 nM | PMID12036373 | BindingDB,ChEMBL |
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