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Target
Substance-P receptor
Ligand
BDBM50217521
Substrate
n/a
Meas. Tech.
ChEMBL_144914 (CHEMBL749479)
IC50
100±n/a nM
Citation
 Nishi, T; Fukazawa, T; Ishibashi, K; Nakajima, K; Sugioka, Y; Iio, Y; Kurata, H; Itoh, K; Mukaiyama, O; Satoh, Y; Yamaguchi, T Combined NK1 and NK2 tachykinin receptor antagonists: synthesis and structure-activity relationships of novel oxazolidine analogues. Bioorg Med Chem Lett 9:875-80 (1999) [PubMed]
Target
Name:
Substance-P receptor
Synonyms:
NK1R_CAVPO | Neurokinin 1 receptor | Neurokinin NK1 | TAC1R | TACR1
Type:
Enzyme Catalytic Domain
Mol. Mass.:
46261.42
Organism:
GUINEA PIG
Description:
Neurokinin NK1 TACR1 GUINEA PIG::P30547
Residue:
407
Sequence:
MDNVLPVDSDLFPNISTNTSEPNQFVQPAWQIVLWAAAYTVIVVTSVVGNVVVMWIILAHKRMRTVTNYFLVNLAFAEASMAAFNTVVNFTYAVHNEWYYGLFYCKFHNFFPIAAVFASIYSMTAVAFDRYMAIIHPLQPRLSATATKVVICVIWVLALLLAFPQGYYSTTETMPGRVVCMIEWPSHPDKIYEKVYHICVTVLIYFLPLLVIGYAYTVVGITLWASEIPGDSSDRYHEQVSAKRKVVKMMIVVVCTFAICWLPFHIFFLLPYINPDLYLKKFIQQVYLAIMWLAMSSTMYNPIIYCCLNDRFRLGFKHAFRCCPFISAADYEGLEMKSTRYFQTQGSVYKVSRLETTISTVVGAHEEDPEEGPKATPSSLDLTSNGSSRSNSKTVTESSSFYSNMLS
  
Inhibitor
Name:
BDBM50217521
Synonyms:
CHEMBL355310
Type:
Small organic molecule
Emp. Form.:
C32H29Cl2F6N3O3
Mol. Mass.:
688.487
SMILES:
NC(=O)C1(CCN(CC[C@]2(CN(CO2)C(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ccc(Cl)c(Cl)c2)CC1)c1ccccc1
Structure:
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