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BDBM50056438 CHEMBL3326571

SMILES: CC1(C)C[C@@H](NC(=O)NC2=CC=CC3NN=CC23)c2ccc(F)cc2O1

InChI Key: InChIKey=JNPIMNXZTQZGNE-AVVWSFFYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50056438   
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
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50056438
PNG
(CHEMBL3326571)
Show SMILES CC1(C)C[C@@H](NC(=O)NC2=CC=CC3NN=CC23)c2ccc(F)cc2O1 |r,c:11,15,t:9|
Show InChI InChI=1S/C19H21FN4O2/c1-19(2)9-16(12-7-6-11(20)8-17(12)26-19)23-18(25)22-14-4-3-5-15-13(14)10-21-24-15/h3-8,10,13,15-16,24H,9H2,1-2H3,(H2,22,23,25)/t13?,15?,16-/m1/s1
PDB
MMDB

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Similars

Article
PubMed
n/an/a 16n/an/an/an/an/an/a



AbbVie Inc.

Curated by ChEMBL


Assay Description
Antagonist activity against human TRPV1 expressed in HEK293 cells assessed as capsaicin-induced calcium flux by FLIPR assay


J Med Chem 57: 7412-24 (2014)


Article DOI: 10.1021/jm500916t
BindingDB Entry DOI: 10.7270/Q2Z3219J
More data for this
Ligand-Target Pair