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Name | Histamine H1 receptor |
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Species | Cavia porcellus (Guinea pig) |
Gene | HRH1 |
Synonym | H1R HH1R |
Disease | N/A for non-human GPCRs |
Length | 488 |
Amino acid sequence | MSFLPGMTPVTLSNFSWALEDRMLEGNSTTTPTRQLMPLVVVLSSVSLVTVALNLLVLYAVRSERKLHTVGNLYIVSLSVADLIVGAVVMPMSILYLHRSAWILGRPLCLFWLSMDYVASTASIFSVFILCIDRYRSVQQPLRYLRYRTKTRASATILGAWLLSFLWVIPILGWHHFMAPTSEPREKKCETDFYDVTWFKVMTAIINFYLPTLLMLWFYIRIYKAVRRHCQHRQLINSSLPSFSEMKLKLENAKVDTRRMGKESPWEDPKRCSKDASGVHTPMPSSQHLVDMPCAAVLSEDEGGEVGTRQMPMLAVGDGRCCEALNHMHSQLELSGQSRATHSISARPEEWTVVDGQSFPITDSDTSTEAAPMGGQPRSGSNSGLDYIKFTWRRLRSHSRQYTSGLHLNRERKAAKQLGCIMAAFILCWIPYFVFFMVIAFCKSCSNEPVHMFTIWLGYLNSTLNPLIYPLCNENFRKTFKRILRIPP |
UniProt | P31389 |
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 | CHEMBL3943 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL302005 |
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Molecular formula | C20H21NO3 |
IUPAC name | 2-[(11E)-11-[2-(dimethylamino)ethylidene]-6H-benzo[c][1]benzoxepin-2-yl]acetic acid |
Molecular weight | 323.392 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 1.0 |
Synonyms | BDBM50002088 [11-(2-Dimethylamino-ethylidene)-6,11-dihydro-dibenzo[b,e]oxepin-2-yl]-acetic acid 6,11-Dihydro-11-[(E)-2-dimethylaminoethylidene]dibenz[b,e]oxepin-2-acetic acid 6,11-Dihydro-11-[2-(dimethylamino)ethylidene]dibenz[b,e]oxepin-2-acetic acid |
Inchi Key | BMMSDSQQAGDCHS-RQZCQDPDSA-N |
Inchi ID | InChI=1S/C20H21NO3/c1-21(2)10-9-17-16-6-4-3-5-15(16)13-24-19-8-7-14(11-18(17)19)12-20(22)23/h3-9,11H,10,12-13H2,1-2H3,(H,22,23)/b17-9+ |
PubChem CID | 15749427 |
ChEMBL | CHEMBL302005 |
IUPHAR | N/A |
BindingDB | 50002088 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 11.0 nM | PMID1350797, PMID8093908 | BindingDB,ChEMBL |
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