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Name | 5-hydroxytryptamine receptor 4 |
---|---|
Species | Homo sapiens (Human) |
Gene | HTR4 |
Synonym | 5-HT-4 5-hydroxytryptamine (serotonin) receptor 4, G protein-coupled 5-HT4 receptor 5-HT4 serotonin receptor 4 |
Disease | N/A |
Length | 388 |
Amino acid sequence | MDKLDANVSSEEGFGSVEKVVLLTFLSTVILMAILGNLLVMVAVCWDRQLRKIKTNYFIVSLAFADLLVSVLVMPFGAIELVQDIWIYGEVFCLVRTSLDVLLTTASIFHLCCISLDRYYAICCQPLVYRNKMTPLRIALMLGGCWVIPTFISFLPIMQGWNNIGIIDLIEKRKFNQNSNSTYCVFMVNKPYAITCSVVAFYIPFLLMVLAYYRIYVTAKEHAHQIQMLQRAGASSESRPQSADQHSTHRMRTETKAAKTLCIIMGCFCLCWAPFFVTNIVDPFIDYTVPGQVWTAFLWLGYINSGLNPFLYAFLNKSFRRAFLIILCCDDERYRRPSILGQTVPCSTTTINGSTHVLRDAVECGGQWESQCHPPATSPLVAAQPSDT |
UniProt | Q13639 |
Protein Data Bank | N/A |
GPCR-HGmod model | Q13639 |
3D structure model | This predicted structure model is from GPCR-EXP Q13639. |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL1875 |
IUPHAR | 9 |
DrugBank | BE0000084 |
Name | CHEMBL408379 |
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Molecular formula | C60H97Cl2N9O9 |
IUPAC name | 2-[4-[11-[[11-[[1-[2-(4-amino-5-chloro-2-methoxybenzoyl)oxyethyl]piperidin-4-yl]amino]-11-oxoundecyl]-[2-oxo-2-(piperidin-4-ylmethylamino)ethyl]amino]undecanoylamino]piperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate |
Molecular weight | 1159.39 |
Hydrogen bond acceptor | 15 |
Hydrogen bond donor | 6 |
XlogP | 10.1 |
Synonyms | BDBM50174437 2-{4-[11-({10-[(1-{2-[(4-amino-5-chloro-2-methoxyphenyl)carbonyloxy]ethyl}piperidin-4-yl)carbamoyl]decyl}({[(piperidin-4-ylmethyl)carbamoyl]methyl})amino)undecanamido]piperidin-1-yl}ethyl 4-amino-5-chloro-2-methoxybenzoate 1-[2-(4-amino-5-chloro-2-methoxyphenylcarbonyloxy)ethyl]-4-{10-[10-{1-[2-(4-amino-5-chloro-2-methoxyphenylcarbonyloxy)ethyl]hexahydro-4-pyridinylcarbamoyl}decyl(hexahydro-4-pyridinylmethylcarbamoylmethyl)amino]decylcarboxamido}hexahydropyridine |
Inchi Key | BEQNXXXLZQEDLW-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C60H97Cl2N9O9/c1-77-54-41-52(63)50(61)39-48(54)59(75)79-37-35-69-31-23-46(24-32-69)67-56(72)19-15-11-7-3-5-9-13-17-29-71(44-58(74)66-43-45-21-27-65-28-22-45)30-18-14-10-6-4-8-12-16-20-57(73)68-47-25-33-70(34-26-47)36-38-80-60(76)49-40-51(62)53(64)42-55(49)78-2/h39-42,45-47,65H,3-38,43-44,63-64H2,1-2H3,(H,66,74)(H,67,72)(H,68,73) |
PubChem CID | 11643822 |
ChEMBL | CHEMBL408379 |
IUPHAR | N/A |
BindingDB | 50174437 |
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. This ligand has a partition coefficient log P greater than 5. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Activity | 10.0 % | PMID17676726 | ChEMBL |
Activity | 114.0 % | PMID17676726 | ChEMBL |
cAMP | 10.0 % | PMID16190749 | ChEMBL |
Ki | 50.0 nM | PMID17676726, PMID16190749 | BindingDB,ChEMBL |
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