Reaction Details | |||
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Target | Substance-P receptor | ||
Ligand | BDBM50029846 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_205712 (CHEMBL807959) | ||
IC50 | 62±n/a nM | ||
Citation | Swain, CJ; Seward, EM; Cascieri, MA; Fong, TM; Herbert, R; MacIntyre, DE; Merchant, KJ; Owen, SN; Owens, AP; Sabin, V Identification of a series of 3-(benzyloxy)-1-azabicyclo[2.2.2]octane human NK1 antagonists. J Med Chem38:4793-805 (1996) [PubMed] | ||
More Info.: | Get all data from this article, Assay Method | ||
Substance-P receptor | |||
Name: | Substance-P receptor | ||
Synonyms: | NK-1 receptor | NK-1R | NK1 Receptor | NK1R | NK1R_HUMAN | Neurokinin 1 receptor | Neurokinin-1 (NK-1) | Neuromedin-1 receptor (NK-1R) | SPR | TAC1R | TACR1 | Tachykinin receptor 1 | Tachykinin receptor 1 (NK1) | tachykinin | ||
Type: | G Protein-Coupled Receptor (GPCR) | ||
Mol. Mass.: | 46254.43 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P25103 | ||
Residue: | 407 | ||
Sequence: |
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BDBM50029846 | |||
n/a | |||
Name | BDBM50029846 | ||
Synonyms: | 2-Benzhydryl-3-(3-chloro-benzyloxy)-1-aza-bicyclo[2.2.2]octane | CHEMBL142638 | ||
Type | Small organic molecule | ||
Emp. Form. | C27H28ClNO | ||
Mol. Mass. | 417.97 | ||
SMILES | Clc1cccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 |(11.58,-.05,;11.58,-1.57,;12.93,-2.33,;12.93,-3.87,;11.59,-4.65,;10.26,-3.87,;8.93,-4.63,;8.92,-6.17,;7.62,-6.94,;6.24,-6.21,;4.93,-7.02,;4.97,-8.57,;6.34,-9.31,;5.59,-8.21,;7.01,-7.34,;7.66,-8.49,;8.99,-9.2,;8.99,-10.74,;7.65,-11.5,;7.65,-13.04,;8.99,-13.81,;10.33,-13.04,;10.33,-11.5,;10.33,-8.44,;11.66,-9.2,;12.99,-8.44,;12.99,-6.9,;11.66,-6.12,;10.33,-6.9,;10.26,-2.33,)| | ||
Structure |