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SMILES: OC1COc2cccc(Nc3cc(ncn3)-c3ccc(cc3)C(F)(F)F)c2C1

InChI Key: InChIKey=WBQUTHJYYXHACE-UHFFFAOYSA-N

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 2 hits for monomerid = 50372579   
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


(Rattus norvegicus (rat))
BDBM50372579
PNG
(CHEMBL403425)
Show SMILES OC1COc2cccc(Nc3cc(ncn3)-c3ccc(cc3)C(F)(F)F)c2C1 |w:1.0|
Show InChI InChI=1S/C20H16F3N3O2/c21-20(22,23)13-6-4-12(5-7-13)17-9-19(25-11-24-17)26-16-2-1-3-18-15(16)8-14(27)10-28-18/h1-7,9,11,14,27H,8,10H2,(H,24,25,26)
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 190n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at rat TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-induced calcium mobilization


Bioorg Med Chem Lett 18: 1830-4 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.022
BindingDB Entry DOI: 10.7270/Q2FB53SJ
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50372579
PNG
(CHEMBL403425)
Show SMILES OC1COc2cccc(Nc3cc(ncn3)-c3ccc(cc3)C(F)(F)F)c2C1 |w:1.0|
Show InChI InChI=1S/C20H16F3N3O2/c21-20(22,23)13-6-4-12(5-7-13)17-9-19(25-11-24-17)26-16-2-1-3-18-15(16)8-14(27)10-28-18/h1-7,9,11,14,27H,8,10H2,(H,24,25,26)
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 10n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-induced calcium mobilization


Bioorg Med Chem Lett 18: 1830-4 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.022
BindingDB Entry DOI: 10.7270/Q2FB53SJ
More data for this
Ligand-Target Pair