Target
Substance-P receptor
Ligand
BDBM50117516
Substrate
n/a
Meas. Tech.
ChEBML_205874
IC50
1.3±n/a nM
Citation
 Seward, EMCarlson, EHarrison, THaworth, KRHerbert, RKelleher, FJKurtz, MMMoseley, JOwen, SNOwens, APSadowski, SJSwain, CJWilliams, 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:
BDBM50117516
Synonyms:
(3S,5S,10S)-5-(4-Fluoro-phenyl)-10-(2-methoxy-5-trifluoromethyl-phenyl)-1,8-dioxa-4-aza-spiro[5.5]undecane | CHEMBL83772
Type:
Small organic molecule
Emp. Form.:
C22H23F4NO3
Mol. Mass.:
425.4165
SMILES:
COc1ccc(cc1[C@H]1COCC2(C1)OCCN[C@H]2c1ccc(F)cc1)C(F)(F)F
Structure:
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