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TargetHistamine H3 receptor
LigandBDBM50263325
Substrate/Competitorn/a
Meas. Tech.ChEMBL_535494 (CHEMBL986121)
IC50 18±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:
BDBM50263325
n/a
NameBDBM50263325
Synonyms:CHEMBL507921 | trans-6'-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
SMILESCOc1ccc2C(=O)O[C@]3(CC[C@@H](CC3)C(=O)N(C)CCN3CCCCC3)c2c1 |r,wU:9.8,wD:12.15,(-5.23,-6.51,;-6.07,-7.8,;-5.38,-9.18,;-6.22,-10.48,;-5.52,-11.85,;-3.99,-11.93,;-3.02,-13.14,;-3.42,-14.62,;-1.57,-12.59,;-1.65,-11.04,;-1.65,-9.5,;-.32,-8.73,;1.01,-9.5,;1.01,-11.04,;-.32,-11.81,;2.35,-8.74,;2.35,-7.2,;3.68,-9.51,;5.01,-8.75,;3.67,-11.05,;5,-11.83,;5,-13.37,;3.66,-14.12,;3.65,-15.66,;4.98,-16.44,;6.32,-15.67,;6.33,-14.13,;-3.14,-10.64,;-3.83,-9.26,)|
Structure
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