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SMILES: CC(C(=O)NCc1ccc(nc1-c1ccc(F)cc1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1

InChI Key: InChIKey=AEQVLCITSYJZAZ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50256581   
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))		BDBM50256581
PNG
(CHEMBL4078240)
Show SMILES CC(C(=O)NCc1ccc(nc1-c1ccc(F)cc1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C26H29F2N3O3S/c1-16(18-8-12-22(21(28)14-18)31-35(5,33)34)25(32)29-15-19-9-13-23(26(2,3)4)30-24(19)17-6-10-20(27)11-7-17/h6-14,16,31H,15H2,1-5H3,(H,29,32)
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PC cid
PC sid
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Article
PubMed
 0.300n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair