Target
Substance-P receptor
Ligand
BDBM50071005
Substrate
n/a
Meas. Tech.
ChEBML_141772
IC50
547±n/a nM
Citation
 Elliott, JMBroughton, HCascieri, MAChicchi, GHuscroft, ITKurtz, MMacLeod, AMSadowski, SStevenson, GI Serine derived NK1 antagonists. 2: A pharmacophore model for arylsulfonamide binding. Bioorg Med Chem Lett 8:1851-6 (1999) [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:
BDBM50071005
Synonyms:
CHEMBL297957 | N-{1-[(S)-2-Benzylamino-3-(3,4-dichloro-benzyloxy)-propionyl]-piperidin-4-ylmethyl}-N-phenyl-methanesulfonamide
Type:
Small organic molecule
Emp. Form.:
C30H35Cl2N3O4S
Mol. Mass.:
604.588
SMILES:
CS(=O)(=O)N(CC1CCN(CC1)C(=O)[C@H](COCc1ccc(Cl)c(Cl)c1)NCc1ccccc1)c1ccccc1
Structure:
Search PDB for entries with ligand similarity: