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PubMed code 29723786

Compile data set for download or QSAR
Found 9 hits of Enzyme Inhibition Constant Data   
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 M member 2


(Homo sapiens (Human))
BDBM50227083
PNG
(CHEMBL173443)
Show SMILES CCCCCc1ccc(\C=C\C(=O)Nc2ccccc2C(O)=O)cc1
Show InChI InChI=1S/C21H23NO3/c1-2-3-4-7-16-10-12-17(13-11-16)14-15-20(23)22-19-9-6-5-8-18(19)21(24)25/h5-6,8-15H,2-4,7H2,1H3,(H,22,23)(H,24,25)/b15-14+
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Article
PubMed
n/an/a 320n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human TRPM2 expressed in HEK293 cells assessed as reduction in ADPR-induced channel currents treated extracellularly after 60 secs by w...


Eur J Med Chem 152: 235-252 (2018)


Article DOI: 10.1016/j.ejmech.2018.04.045
BindingDB Entry DOI: 10.7270/Q22J6FDS
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily M member 2


(Homo sapiens (Human))
BDBM50227083
PNG
(CHEMBL173443)
Show SMILES CCCCCc1ccc(\C=C\C(=O)Nc2ccccc2C(O)=O)cc1
Show InChI InChI=1S/C21H23NO3/c1-2-3-4-7-16-10-12-17(13-11-16)14-15-20(23)22-19-9-6-5-8-18(19)21(24)25/h5-6,8-15H,2-4,7H2,1H3,(H,22,23)(H,24,25)/b15-14+
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Article
PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human TRPM2 expressed in HEK293 cells assessed as reduction in H2O2-induced intracellular calcium flux after 30 mins by Fluo4-AM dye ba...


Eur J Med Chem 152: 235-252 (2018)


Article DOI: 10.1016/j.ejmech.2018.04.045
BindingDB Entry DOI: 10.7270/Q22J6FDS
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily M member 2


(Homo sapiens (Human))
BDBM50227083
PNG
(CHEMBL173443)
Show SMILES CCCCCc1ccc(\C=C\C(=O)Nc2ccccc2C(O)=O)cc1
Show InChI InChI=1S/C21H23NO3/c1-2-3-4-7-16-10-12-17(13-11-16)14-15-20(23)22-19-9-6-5-8-18(19)21(24)25/h5-6,8-15H,2-4,7H2,1H3,(H,22,23)(H,24,25)/b15-14+
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n/an/a 1.70E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human TRPM2 expressed in HEK293 cells assessed as reduction in ADPR-induced channel currents by whole cell patch clamp electrophysiolog...


Eur J Med Chem 152: 235-252 (2018)


Article DOI: 10.1016/j.ejmech.2018.04.045
BindingDB Entry DOI: 10.7270/Q22J6FDS
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily M member 2


(Homo sapiens (Human))
BDBM50405913
PNG
(CHEMBL4176916)
Show SMILES Cc1cc(Br)cc2C(=O)NC(Nc12)c1c[nH]nc1-c1cccc2ccccc12
Show InChI InChI=1S/C19H31NO4S/c1-2-11-20-18(21)13-25-12-15-14(16-9-10-17(15)24-16)7-5-3-4-6-8-19(22)23/h3,5,14-17H,2,4,6-13H2,1H3,(H,20,21)(H,22,23)/b5-3-
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n/an/a 3.70E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human TRPM2 expressed in HEK293 cells assessed as reduction in ADPR-induced channel currents treated extracellularly after 60 secs by w...


Eur J Med Chem 152: 235-252 (2018)


Article DOI: 10.1016/j.ejmech.2018.04.045
BindingDB Entry DOI: 10.7270/Q22J6FDS
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily M member 8


(Homo sapiens (Human))
BDBM50227083
PNG
(CHEMBL173443)
Show SMILES CCCCCc1ccc(\C=C\C(=O)Nc2ccccc2C(O)=O)cc1
Show InChI InChI=1S/C21H23NO3/c1-2-3-4-7-16-10-12-17(13-11-16)14-15-20(23)22-19-9-6-5-8-18(19)21(24)25/h5-6,8-15H,2-4,7H2,1H3,(H,22,23)(H,24,25)/b15-14+
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n/an/a 3.90E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human TRPM8 expressed in HEK293 cells assessed as reduction in H2O2-induced intracellular calcium flux after 30 mins by Fluo4-AM dye ba...


Eur J Med Chem 152: 235-252 (2018)


Article DOI: 10.1016/j.ejmech.2018.04.045
BindingDB Entry DOI: 10.7270/Q22J6FDS
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily M member 2


(Homo sapiens (Human))
BDBM50405912
PNG
(CHEMBL4159037)
Show SMILES Cc1cc(Cl)cc2C(=O)NC(Nc12)c1c[nH]nc1-c1cccc2ccccc12
Show InChI InChI=1S/C20H26O3S/c21-20(22)11-7-2-1-6-10-16-17(19-13-12-18(16)23-19)14-24-15-8-4-3-5-9-15/h1,3-6,8-9,16-19H,2,7,10-14H2,(H,21,22)/b6-1-
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n/an/a 4.00E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human TRPM2 expressed in HEK293 cells assessed as reduction in ADPR-induced channel currents treated extracellularly after 60 secs by w...


Eur J Med Chem 152: 235-252 (2018)


Article DOI: 10.1016/j.ejmech.2018.04.045
BindingDB Entry DOI: 10.7270/Q22J6FDS
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily M member 2


(Homo sapiens (Human))
BDBM50405910
PNG
(CHEMBL4174768)
Show SMILES Cc1cc(Br)cc2C(=O)NC(Nc12)c1c[nH]nc1-c1ccccc1
Show InChI InChI=1S/C20H34O3S/c1-2-3-4-7-10-15-24-20-16(17-13-14-18(20)23-17)11-8-5-6-9-12-19(21)22/h5,8,16-18,20H,2-4,6-7,9-15H2,1H3,(H,21,22)/b8-5-
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n/an/a 4.60E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human TRPM2 expressed in HEK293 cells assessed as reduction in ADPR-induced channel currents treated extracellularly after 60 secs by w...


Eur J Med Chem 152: 235-252 (2018)


Article DOI: 10.1016/j.ejmech.2018.04.045
BindingDB Entry DOI: 10.7270/Q22J6FDS
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily M member 2


(Homo sapiens (Human))
BDBM50405911
PNG
(CHEMBL4167784)
Show SMILES Cc1cc(Cl)cc2C(=O)NC(Nc12)c1c[nH]nc1-c1ccccc1
Show InChI InChI=1S/C23H30O3S/c24-23(25)13-7-2-1-6-12-19-20(22-15-14-21(19)26-22)17-27-16-8-11-18-9-4-3-5-10-18/h1,3-6,8-11,19-22H,2,7,12-17H2,(H,24,25)/b6-1-,11-8+
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n/an/a 5.10E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human TRPM2 expressed in HEK293 cells assessed as reduction in ADPR-induced channel currents treated extracellularly after 60 secs by w...


Eur J Med Chem 152: 235-252 (2018)


Article DOI: 10.1016/j.ejmech.2018.04.045
BindingDB Entry DOI: 10.7270/Q22J6FDS
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily M member 2


(Homo sapiens (Human))
BDBM18137
PNG
(AMP | CHEMBL752 | US11185100, TABLE 7.3 | [(2R,3S,...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1
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Article
PubMed
n/an/a 7.00E+4n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human TRPM2 assessed as reduction in ADPR-induced channel currents by whole cell patch clamp electrophysiology method


Eur J Med Chem 152: 235-252 (2018)


Article DOI: 10.1016/j.ejmech.2018.04.045
BindingDB Entry DOI: 10.7270/Q22J6FDS
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%