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BDBM50388086 CHEMBL2057858

SMILES: COc1cc(ccc1OCCN)C(C)C(=O)NCCCc1ccc(C)c(C)c1

InChI Key: InChIKey=WVJARODAMMHDHV-UHFFFAOYSA-N

Data: 1 KI  1 EC50

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 = 50388086   
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
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50388086
PNG
(CHEMBL2057858)
Show SMILES COc1cc(ccc1OCCN)C(C)C(=O)NCCCc1ccc(C)c(C)c1
Show InChI InChI=1S/C23H32N2O3/c1-16-7-8-19(14-17(16)2)6-5-12-25-23(26)18(3)20-9-10-21(28-13-11-24)22(15-20)27-4/h7-10,14-15,18H,5-6,11-13,24H2,1-4H3,(H,25,26)
PDB
MMDB

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
518n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]RTX from rat TRPV1 expressed in CHO cells


Bioorg Med Chem Lett 22: 5227-31 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.059
BindingDB Entry DOI: 10.7270/Q2NS0VZB
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50388086
PNG
(CHEMBL2057858)
Show SMILES COc1cc(ccc1OCCN)C(C)C(=O)NCCCc1ccc(C)c(C)c1
Show InChI InChI=1S/C23H32N2O3/c1-16-7-8-19(14-17(16)2)6-5-12-25-23(26)18(3)20-9-10-21(28-13-11-24)22(15-20)27-4/h7-10,14-15,18H,5-6,11-13,24H2,1-4H3,(H,25,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 404n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Agonist activity at rat TRPV1 expressed in CHO cells assessed as calcium uptake


Bioorg Med Chem Lett 22: 5227-31 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.059
BindingDB Entry DOI: 10.7270/Q2NS0VZB
More data for this
Ligand-Target Pair