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TargetHistamine H3 receptor
LigandBDBM50263357
Substrate/Competitorn/a
Meas. Tech.ChEMBL_535494 (CHEMBL986121)
IC50 3.6±n/a nM
Citation Jitsuoka, MTsukahara, DIto, STanaka, TTakenaga, NTokita, SSato, N Synthesis and evaluation of a spiro-isobenzofuranone class of histamine H3 receptor inverse agonists. Bioorg Med Chem Lett18:5101-6 (2008) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Histamine H3 receptor
Name:Histamine H3 receptor
Synonyms:G-protein coupled receptor 97 | GPCR97 | HH3R | HISTAMINE H3 | HRH3 | HRH3_HUMAN | Histamine H3 receptor (H3) | Histamine H3L | Histamine receptor (H3 and H4)
Type:G Protein-Coupled Receptor (GPCR)
Mol. Mass.:48691.47
Organism:Homo sapiens (Human)
Description:Binding assays were using CHO cells stably expressing hH3R receptors.
Residue:445
Sequence:
MERAPPDGPLNASGALAGEAAAAGGARGFSAAWTAVLAALMALLIVATVLGNALVMLAFV
ADSSLRTQNNFFLLNLAISDFLVGAFCIPLYVPYVLTGRWTFGRGLCKLWLVVDYLLCTS
SAFNIVLISYDRFLSVTRAVSYRAQQGDTRRAVRKMLLVWVLAFLLYGPAILSWEYLSGG
SSIPEGHCYAEFFYNWYFLITASTLEFFTPFLSVTFFNLSIYLNIQRRTRLRLDGAREAA
GPEPPPEAQPSPPPPPGCWGCWQKGHGEAMPLHRYGVGEAAVGAEAGEATLGGGGGGGSV
ASPTSSSGSSSRGTERPRSLKRGSKPSASSASLEKRMKMVSQSFTQRFRLSRDRKVAKSL
AVIVSIFGLCWAPYTLLMIIRAACHGHCVPDYWYETSFWLLWANSAVNPVLYPLCHHSFR
RAFTKLLCPQKLKIQPHSSLEHCWK
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50263357
n/a
NameBDBM50263357
Synonyms:CHEMBL478434 | trans-7'-Methoxy-3'-oxo-3'H-spiro[cyclohexane-1,1'-isobenzofuran]-4-carboxylic acid methyl-(2-piperidin-1-yl-ethyl)-amide
TypeSmall organic molecule
Emp. Form.C23H32N2O4
Mol. Mass.400.5112
SMILESCOc1cccc2C(=O)O[C@]3(CC[C@@H](CC3)C(=O)N(C)CCN3CCCCC3)c12 |r,wU:10.9,wD:13.16,(14.73,-6.83,;15.42,-8.21,;14.58,-9.5,;13.03,-9.41,;12.19,-10.71,;12.89,-12.08,;14.42,-12.17,;15.39,-13.37,;14.99,-14.86,;16.84,-12.82,;16.76,-11.28,;16.76,-9.74,;18.09,-8.96,;19.42,-9.74,;19.42,-11.28,;18.09,-12.04,;20.76,-8.97,;20.76,-7.43,;22.09,-9.75,;23.42,-8.98,;22.08,-11.29,;23.41,-12.06,;23.41,-13.6,;22.07,-14.36,;22.06,-15.89,;23.39,-16.67,;24.73,-15.91,;24.74,-14.36,;15.27,-10.87,)|
Structure
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