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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Transient receptor potential cation channel subfamily V member 1' and Ligand = 'BDBM50330656'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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))
BDBM50330656
PNG
(2-(4-tert-Butylbenzyl)-3-[2-(3-bromo-4-hydroxy-5-m...)
Show SMILES COc1cc(CC(=O)NCC(COC(=O)C(C)(C)C)Cc2ccc(cc2)C(C)(C)C)cc(Br)c1O
Show InChI InChI=1S/C28H38BrNO5/c1-27(2,3)21-10-8-18(9-11-21)12-20(17-35-26(33)28(4,5)6)16-30-24(31)15-19-13-22(29)25(32)23(14-19)34-7/h8-11,13-14,20,32H,12,15-17H2,1-7H3,(H,30,31)
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PC cid
PC sid
UniChem

Similars

Article
PubMed
8.77n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


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


Bioorg Med Chem 18: 8092-105 (2010)


Article DOI: 10.1016/j.bmc.2010.09.001
BindingDB Entry DOI: 10.7270/Q2Q81D98
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Rattus norvegicus (rat))
BDBM50330656
PNG
(2-(4-tert-Butylbenzyl)-3-[2-(3-bromo-4-hydroxy-5-m...)
Show SMILES COc1cc(CC(=O)NCC(COC(=O)C(C)(C)C)Cc2ccc(cc2)C(C)(C)C)cc(Br)c1O
Show InChI InChI=1S/C28H38BrNO5/c1-27(2,3)21-10-8-18(9-11-21)12-20(17-35-26(33)28(4,5)6)16-30-24(31)15-19-13-22(29)25(32)23(14-19)34-7/h8-11,13-14,20,32H,12,15-17H2,1-7H3,(H,30,31)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
9.40n/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 18: 8092-105 (2010)


Article DOI: 10.1016/j.bmc.2010.09.001
BindingDB Entry DOI: 10.7270/Q2Q81D98
More data for this
Ligand-Target Pair