Reaction Details |
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Target | Substance-P receptor |
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Ligand | BDBM50218239 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_457052 (CHEMBL923388) |
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IC50 | 0.06±n/a nM |
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Citation | Lin, P; Chang, L; Devita, RJ; Young, JR; Eid, R; Tong, X; Zheng, S; Ball, RG; Tsou, NN; Chicchi, GG; Kurtz, MM; Tsao, KL; Wheeldon, A; Carlson, EJ; Eng, W; Burns, HD; Hargreaves, RJ; Mills, SG The discovery of potent, selective, and orally bioavailable hNK1 antagonists derived from pyrrolidine. Bioorg Med Chem Lett17:5191-8 (2007) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Substance-P receptor |
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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: | MDNVLPVDSDLSPNISTNTSEPNQFVQPAWQIVLWAAAYTVIVVTSVVGNVVVMWIILAH
KRMRTVTNYFLVNLAFAEASMAAFNTVVNFTYAVHNEWYYGLFYCKFHNFFPIAAVFASI
YSMTAVAFDRYMAIIHPLQPRLSATATKVVICVIWVLALLLAFPQGYYSTTETMPSRVVC
MIEWPEHPNKIYEKVYHICVTVLIYFLPLLVIGYAYTVVGITLWASEIPGDSSDRYHEQV
SAKRKVVKMMIVVVCTFAICWLPFHIFFLLPYINPDLYLKKFIQQVYLAIMWLAMSSTMY
NPIIYCCLNDRFRLGFKHAFRCCPFISAGDYEGLEMKSTRYLQTQGSVYKVSRLETTIST
VVGAHEEEPEDGPKATPSSLDLTSNCSSRSDSKTMTESFSFSSNVLS
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BDBM50218239 |
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n/a |
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Name | BDBM50218239 |
Synonyms: | (3S,4R)-3-((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-4-(4-fluorophenyl)-N-isopropylpyrrolidine-1-carboxamide | CHEMBL398720 |
Type | Small organic molecule |
Emp. Form. | C24H25F7N2O2 |
Mol. Mass. | 506.4563 |
SMILES | CC(C)NC(=O)N1C[C@@H](O[C@H](C)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)[C@@H](C1)c1ccc(F)cc1 |
Structure |
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