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BDBM50436558 CHEMBL2397484

SMILES: CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@@H](N)Cc1ccccc1

InChI Key: InChIKey=DWMKCXGQQSHKOR-IRXDYDNUSA-N

Data: 1 KI

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50436558   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Neurokinin 1 receptor


(Rattus norvegicus (rat))
BDBM50436558
PNG
(CHEMBL2397484)
Show SMILES CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@@H](N)Cc1ccccc1 |r|
Show InChI InChI=1S/C19H23N3O2/c1-22(17(18(21)23)13-15-10-6-3-7-11-15)19(24)16(20)12-14-8-4-2-5-9-14/h2-11,16-17H,12-13,20H2,1H3,(H2,21,23)/t16-,17-/m0/s1
PDB
MMDB

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UniProtKB/SwissProt

B.MOAD
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
9.40n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Displacement of [3H]SP1-7 from substance P receptor (1 to 7 amino acids) binding site in Sprague-Dawley rat spinal cord membranes after 60 mins by li...


J Med Chem 56: 4953-65 (2013)


Article DOI: 10.1021/jm400209h
BindingDB Entry DOI: 10.7270/Q2K075PK
More data for this
Ligand-Target Pair