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Target
Substance-P receptor
Ligand
BDBM50456633
Substrate
n/a
Meas. Tech.
ChEMBL_1757658 (CHEMBL4192666)
EC50
350000±n/a nM
Citation
 Recio, R; Vengut-Climent, E; Mouillac, B; Orcel, H; López-Lázaro, M; Calderón-Montaño, JM; Álvarez, E; Khiar, N; Fernández, I Design, synthesis and biological studies of a library of NK1-Receptor Ligands Based on a 5-arylthiosubstituted 2-amino-4,6-diaryl-3-cyano-4H-pyran core: Switch from antagonist to agonist effect by chemical modification. Eur J Med Chem 138:644-660 (2017) [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:
BDBM50456633
Synonyms:
CHEMBL4215185
Type:
Small organic molecule
Emp. Form.:
C26H17F3N4O5S
Mol. Mass.:
554.497
SMILES:
Cc1ccc(cc1)[S+]([O-])C1=C(OC(NC(=O)C(F)(F)F)=C(C#N)[C@H]1c1ccc(cc1)[N+]([O-])=O)c1ccccn1 |r,t:10,20|
Structure:
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