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Target
Substance-P receptor
Ligand
BDBM50117510
Substrate
n/a
Meas. Tech.
ChEBML_205874
IC50
1.1±n/a nM
Citation
 Seward, EM; Carlson, E; Harrison, T; Haworth, KR; Herbert, R; Kelleher, FJ; Kurtz, MM; Moseley, J; Owen, SN; Owens, AP; Sadowski, SJ; Swain, CJ; Williams, BJ Spirocyclic NK(1) antagonists I: [4.5] and [5.5]-spiroketals. Bioorg Med Chem Lett 12:2515-8 (2002) [PubMed]  Article 
Target
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:
MDNVLPVDSDLSPNISTNTSEPNQFVQPAWQIVLWAAAYTVIVVTSVVGNVVVMWIILAHKRMRTVTNYFLVNLAFAEASMAAFNTVVNFTYAVHNEWYYGLFYCKFHNFFPIAAVFASIYSMTAVAFDRYMAIIHPLQPRLSATATKVVICVIWVLALLLAFPQGYYSTTETMPSRVVCMIEWPEHPNKIYEKVYHICVTVLIYFLPLLVIGYAYTVVGITLWASEIPGDSSDRYHEQVSAKRKVVKMMIVVVCTFAICWLPFHIFFLLPYINPDLYLKKFIQQVYLAIMWLAMSSTMYNPIIYCCLNDRFRLGFKHAFRCCPFISAGDYEGLEMKSTRYLQTQGSVYKVSRLETTISTVVGAHEEEPEDGPKATPSSLDLTSNCSSRSDSKTMTESFSFSSNVLS
  
Inhibitor
Name:
BDBM50117510
Synonyms:
CHEMBL84881 | {5-[5-(4-Fluoro-phenyl)-9-(2-trifluoromethyl-phenyl)-1,7-dioxa-4-aza-spiro[5.5]undec-4-ylmethyl]-3H-[1,2,3]triazol-4-ylmethyl}-dimethyl-amine
Type:
Small organic molecule
Emp. Form.:
C27H31F4N5O2
Mol. Mass.:
533.561
SMILES:
CN(C)Cc1nn[nH]c1CN1CCOC2(CCC(CO2)c2ccccc2C(F)(F)F)C1c1ccc(F)cc1
Structure:
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