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BDBM50398527 CHEMBL2179154

SMILES: CC(C(=O)NCc1ccc(nc1N1CCN(CC1)c1ncccc1Cl)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1

InChI Key: InChIKey=POVISUPNMKAOHM-UHFFFAOYSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50398527   
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))
BDBM50398527
PNG
(CHEMBL2179154)
Show SMILES CC(C(=O)NCc1ccc(nc1N1CCN(CC1)c1ncccc1Cl)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C26H27ClF4N6O3S/c1-16(17-5-7-21(20(28)14-17)35-41(2,39)40)25(38)33-15-18-6-8-22(26(29,30)31)34-23(18)36-10-12-37(13-11-36)24-19(27)4-3-9-32-24/h3-9,14,16,35H,10-13,15H2,1-2H3,(H,33,38)
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PC cid
PC sid
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Similars

Article
PubMed
2.10n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin-induced activity by FLIPR assay


J Med Chem 55: 8392-408 (2012)


Article DOI: 10.1021/jm300780p
BindingDB Entry DOI: 10.7270/Q2TX3GH1
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50398527
PNG
(CHEMBL2179154)
Show SMILES CC(C(=O)NCc1ccc(nc1N1CCN(CC1)c1ncccc1Cl)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C26H27ClF4N6O3S/c1-16(17-5-7-21(20(28)14-17)35-41(2,39)40)25(38)33-15-18-6-8-22(26(29,30)31)34-23(18)36-10-12-37(13-11-36)24-19(27)4-3-9-32-24/h3-9,14,16,35H,10-13,15H2,1-2H3,(H,33,38)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 117n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of pH-induced activity by FLIPR assay


J Med Chem 55: 8392-408 (2012)


Article DOI: 10.1021/jm300780p
BindingDB Entry DOI: 10.7270/Q2TX3GH1
More data for this
Ligand-Target Pair