Reaction Details  Report a problem with these data
Target
Substance-P receptor
Ligand
BDBM50276158
Substrate
n/a
Meas. Tech.
ChEMBL_1715426 (CHEMBL4125475)
Ki
1.8±n/a nM
Citation
 Skogh, A; Lesniak, A; Sköld, C; Karlgren, M; Gaugaz, FZ; Svensson, R; Diwakarla, S; Jonsson, A; Fransson, R; Nyberg, F; Hallberg, M; Sandström, A An imidazole based H-Phe-Phe-NH Bioorg Med Chem Lett 28:2446-2450 (2018) [PubMed]  Article
Target
Name:
Substance-P receptor
Synonyms:
NK-1 receptor | NK-1R | NK1 Receptor | NK1R_RAT | Neurokinin 1 receptor | Neurokinin NK1 | SPR | Substance-P receptor | Tac1r | Tachykinin receptor 1 | Tacr1
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
46371.54
Organism:
Rattus norvegicus (rat)
Description:
Competition binding assays were carried out using membrane preparations from transfected CHO cells that constitutively expressed the rat NK1 receptor.
Residue:
407
Sequence:
MDNVLPMDSDLFPNISTNTSESNQFVQPTWQIVLWAAAYTVIVVTSVVGNVVVIWIILAHKRMRTVTNYFLVNLAFAEACMAAFNTVVNFTYAVHNVWYYGLFYCKFHNFFPIAALFASIYSMTAVAFDRYMAIIHPLQPRLSATATKVVIFVIWVLALLLAFPQGYYSTTETMPSRVVCMIEWPEHPNRTYEKAYHICVTVLIYFLPLLVIGYAYTVVGITLWASEIPGDSSDRYHEQVSAKRKVVKMMIVVVCTFAICWLPFHVFFLLPYINPDLYLKKFIQQVYLASMWLAMSSTMYNPIIYCCLNDRFRLGFKHAFRCCPFISAGDYEGLEMKSTRYLQTQSSVYKVSRLETTISTVVGAHEEEPEEGPKATPSSLDLTSNGSSRSNSKTMTESSSFYSNMLA
  
Inhibitor
Name:
BDBM50276158
Synonyms:
CHEMBL4127872
Type:
Small organic molecule
Emp. Form.:
C41H65N13O10
Mol. Mass.:
900.0359
SMILES:
NCCCC[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](N)CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1ccccc1)C(O)=O |r|
Structure:
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