BindingDB logo
myBDB logout

BDBM50454330 CHEMBL4205059

SMILES: Cc1ccc(cc1)-c1cc(C(=O)N2CCN(CC2)C(=O)Nc2ccc(cc2)C(F)(F)F)c2cccc(Cl)c2n1

InChI Key: InChIKey=NYQWHELPSMXDJW-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50454330   
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))		BDBM50454330
PNG
(CHEMBL4205059)
Show SMILES Cc1ccc(cc1)-c1cc(C(=O)N2CCN(CC2)C(=O)Nc2ccc(cc2)C(F)(F)F)c2cccc(Cl)c2n1
Show InChI InChI=1S/C29H24ClF3N4O2/c1-18-5-7-19(8-6-18)25-17-23(22-3-2-4-24(30)26(22)35-25)27(38)36-13-15-37(16-14-36)28(39)34-21-11-9-20(10-12-21)29(31,32)33/h2-12,17H,13-16H2,1H3,(H,34,39)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 26n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 assessed as inhibition of capsaicin-induced intracellular calcium level preincubated for 2.5 mins followed by caps...

Bioorg Med Chem 26: 845-854 (2018)


Article DOI: 10.1016/j.bmc.2017.12.048
BindingDB Entry DOI: 10.7270/Q27S7RDV
More data for this
Ligand-Target Pair