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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 1/2/4' and Ligand = 'BDBM50223206'   
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 1/2/4


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50223206
PNG
(CHEMBL289694)
Show SMILES CCCC(CCc1ccc(O)c(OC)c1)O\C(S)=N\CCc1ccccc1
Show InChI InChI=1S/C22H29NO3S/c1-3-7-19(12-10-18-11-13-20(24)21(16-18)25-2)26-22(27)23-15-14-17-8-5-4-6-9-17/h4-6,8-9,11,13,16,19,24H,3,7,10,12,14-15H2,1-2H3,(H,23,27)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 2.79E+4n/an/an/an/an/an/a



Sookmyung Women's University

Curated by ChEMBL


Assay Description
Ability to inhibit [Ca2+] influx neonatal rat cultured spinal sensory neurons.


Bioorg Med Chem Lett 13: 1549-52 (2003)


BindingDB Entry DOI: 10.7270/Q2571F5K
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1/2/4


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50223206
PNG
(CHEMBL289694)
Show SMILES CCCC(CCc1ccc(O)c(OC)c1)O\C(S)=N\CCc1ccccc1
Show InChI InChI=1S/C22H29NO3S/c1-3-7-19(12-10-18-11-13-20(24)21(16-18)25-2)26-22(27)23-15-14-17-8-5-4-6-9-17/h4-6,8-9,11,13,16,19,24H,3,7,10,12,14-15H2,1-2H3,(H,23,27)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a>1.00E+5n/an/an/an/a



Sookmyung Women's University

Curated by ChEMBL


Assay Description
Ability to cause [Ca2+] influx in neonatal rat cultured spinal sensory neurons.


Bioorg Med Chem Lett 13: 1549-52 (2003)


BindingDB Entry DOI: 10.7270/Q2571F5K
More data for this
Ligand-Target Pair