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Compile Data Set for Download or QSAR

Found 24 hits with Last Name = 'abramovitz' and Initial = 'a'   
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


(Homo sapiens (Human))
BDBM50398494
PNG
(CHEMBL2177429)
Show SMILES C[C@H](C(=O)NCc1ccc(nc1N1CCC(C)CC1)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C23H28F4N4O3S/c1-14-8-10-31(11-9-14)21-17(5-7-20(29-21)23(25,26)27)13-28-22(32)15(2)16-4-6-19(18(24)12-16)30-35(3,33)34/h4-7,12,14-15,30H,8-11,13H2,1-3H3,(H,28,32)/t15-/m0/s1
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1.30n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-induced 45Ca2+ uptake incubated for 5 mins by liquid sc...


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50049553
PNG
(CHEMBL2177428)
Show SMILES CC(C(=O)NCc1ccc(nc1N1CCC(C)CC1)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C23H28F4N4O3S/c1-14-8-10-31(11-9-14)21-17(5-7-20(29-21)23(25,26)27)13-28-22(32)15(2)16-4-6-19(18(24)12-16)30-35(3,33)34/h4-7,12,14-15,30H,8-11,13H2,1-3H3,(H,28,32)
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2.20n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-induced 45Ca2+ uptake incubated for 5 mins by liquid sc...


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50398494
PNG
(CHEMBL2177429)
Show SMILES C[C@H](C(=O)NCc1ccc(nc1N1CCC(C)CC1)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C23H28F4N4O3S/c1-14-8-10-31(11-9-14)21-17(5-7-20(29-21)23(25,26)27)13-28-22(32)15(2)16-4-6-19(18(24)12-16)30-35(3,33)34/h4-7,12,14-15,30H,8-11,13H2,1-3H3,(H,28,32)/t15-/m0/s1
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3n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]-resiniferatoxin from human TRPV1 expressed in CHO cells incubated for 60 mins by scintillation counting analysis


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM125059
PNG
(US8765733, 24)
Show SMILES CC1CCN(CC1)c1nc(ccc1CNC(=O)Nc1ccc(CNS(C)(=O)=O)c(F)c1)C(F)(F)F
Show InChI InChI=1S/C22H27F4N5O3S/c1-14-7-9-31(10-8-14)20-16(4-6-19(30-20)22(24,25)26)12-27-21(32)29-17-5-3-15(18(23)11-17)13-28-35(2,33)34/h3-6,11,14,28H,7-10,12-13H2,1-2H3,(H2,27,29,32)
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6.80n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]-resiniferatoxin from human TRPV1 expressed in CHO cells incubated for 60 mins by scintillation counting analysis


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50049553
PNG
(CHEMBL2177428)
Show SMILES CC(C(=O)NCc1ccc(nc1N1CCC(C)CC1)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C23H28F4N4O3S/c1-14-8-10-31(11-9-14)21-17(5-7-20(29-21)23(25,26)27)13-28-22(32)15(2)16-4-6-19(18(24)12-16)30-35(3,33)34/h4-7,12,14-15,30H,8-11,13H2,1-3H3,(H,28,32)
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7.90n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]-resiniferatoxin from human TRPV1 expressed in CHO cells incubated for 60 mins by scintillation counting analysis


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM125059
PNG
(US8765733, 24)
Show SMILES CC1CCN(CC1)c1nc(ccc1CNC(=O)Nc1ccc(CNS(C)(=O)=O)c(F)c1)C(F)(F)F
Show InChI InChI=1S/C22H27F4N5O3S/c1-14-7-9-31(10-8-14)20-16(4-6-19(30-20)22(24,25)26)12-27-21(32)29-17-5-3-15(18(23)11-17)13-28-35(2,33)34/h3-6,11,14,28H,7-10,12-13H2,1-2H3,(H2,27,29,32)
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13n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-induced 45Ca2+ uptake incubated for 5 mins by liquid sc...


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185816
PNG
(CHEMBL3822908)
Show SMILES CC1CCN(CC1)c1nc(ccc1CNC(=O)NCc1ccc(NS(C)(=O)=O)c(F)c1)C(F)(F)F
Show InChI InChI=1S/C22H27F4N5O3S/c1-14-7-9-31(10-8-14)20-16(4-6-19(29-20)22(24,25)26)13-28-21(32)27-12-15-3-5-18(17(23)11-15)30-35(2,33)34/h3-6,11,14,30H,7-10,12-13H2,1-2H3,(H2,27,28,32)
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19n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-induced 45Ca2+ uptake incubated for 5 mins by liquid sc...


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185817
PNG
(CHEMBL3822842)
Show SMILES CC(NC(=O)NCc1ccc(nc1N1CCC(C)CC1)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C23H29F4N5O3S/c1-14-8-10-32(11-9-14)21-17(5-7-20(30-21)23(25,26)27)13-28-22(33)29-15(2)16-4-6-19(18(24)12-16)31-36(3,34)35/h4-7,12,14-15,31H,8-11,13H2,1-3H3,(H2,28,29,33)
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28n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-induced 45Ca2+ uptake incubated for 5 mins by liquid sc...


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185770
PNG
(CHEMBL3822749)
Show SMILES CC(C(=O)NCc1ccc(nc1N1CCC(C)CC1)C(F)(F)F)c1ccc(CNS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C24H30F4N4O3S/c1-15-8-10-32(11-9-15)22-19(6-7-21(31-22)24(26,27)28)13-29-23(33)16(2)17-4-5-18(20(25)12-17)14-30-36(3,34)35/h4-7,12,15-16,30H,8-11,13-14H2,1-3H3,(H,29,33)
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28n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-induced 45Ca2+ uptake incubated for 5 mins by liquid sc...


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185817
PNG
(CHEMBL3822842)
Show SMILES CC(NC(=O)NCc1ccc(nc1N1CCC(C)CC1)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C23H29F4N5O3S/c1-14-8-10-32(11-9-14)21-17(5-7-20(30-21)23(25,26)27)13-28-22(33)29-15(2)16-4-6-19(18(24)12-16)31-36(3,34)35/h4-7,12,14-15,31H,8-11,13H2,1-3H3,(H2,28,29,33)
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32n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]-resiniferatoxin from human TRPV1 expressed in CHO cells incubated for 60 mins by scintillation counting analysis


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185769
PNG
(CHEMBL3823425)
Show SMILES CC(C(=O)NCCc1ccc(nc1N1CCC(C)CC1)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C24H30F4N4O3S/c1-15-9-12-32(13-10-15)22-17(5-7-21(30-22)24(26,27)28)8-11-29-23(33)16(2)18-4-6-20(19(25)14-18)31-36(3,34)35/h4-7,14-16,31H,8-13H2,1-3H3,(H,29,33)
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54n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]-resiniferatoxin from human TRPV1 expressed in CHO cells incubated for 60 mins by scintillation counting analysis


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185814
PNG
(CHEMBL3822772)
Show SMILES CC1CCN(CC1)c1nc(ccc1CNC(=O)N(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(F)(F)F
Show InChI InChI=1S/C22H27F4N5O3S/c1-14-8-10-31(11-9-14)20-15(4-7-19(28-20)22(24,25)26)13-27-21(32)30(2)16-5-6-18(17(23)12-16)29-35(3,33)34/h4-7,12,14,29H,8-11,13H2,1-3H3,(H,27,32)
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59n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-induced 45Ca2+ uptake incubated for 5 mins by liquid sc...


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185816
PNG
(CHEMBL3822908)
Show SMILES CC1CCN(CC1)c1nc(ccc1CNC(=O)NCc1ccc(NS(C)(=O)=O)c(F)c1)C(F)(F)F
Show InChI InChI=1S/C22H27F4N5O3S/c1-14-7-9-31(10-8-14)20-16(4-6-19(29-20)22(24,25)26)13-28-21(32)27-12-15-3-5-18(17(23)11-15)30-35(2,33)34/h3-6,11,14,30H,7-10,12-13H2,1-2H3,(H2,27,28,32)
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59n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]-resiniferatoxin from human TRPV1 expressed in CHO cells incubated for 60 mins by scintillation counting analysis


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185771
PNG
(CHEMBL3824160)
Show SMILES CC1CCN(CC1)c1nc(ccc1CNC(=O)Nc1ccc(NS(C)(=O)=O)c(F)c1)C(F)(F)F
Show InChI InChI=1S/C21H25F4N5O3S/c1-13-7-9-30(10-8-13)19-14(3-6-18(28-19)21(23,24)25)12-26-20(31)27-15-4-5-17(16(22)11-15)29-34(2,32)33/h3-6,11,13,29H,7-10,12H2,1-2H3,(H2,26,27,31)
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83n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]-resiniferatoxin from human TRPV1 expressed in CHO cells incubated for 60 mins by scintillation counting analysis


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185769
PNG
(CHEMBL3823425)
Show SMILES CC(C(=O)NCCc1ccc(nc1N1CCC(C)CC1)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C24H30F4N4O3S/c1-15-9-12-32(13-10-15)22-17(5-7-21(30-22)24(26,27)28)8-11-29-23(33)16(2)18-4-6-20(19(25)14-18)31-36(3,34)35/h4-7,14-16,31H,8-13H2,1-3H3,(H,29,33)
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95n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-induced 45Ca2+ uptake incubated for 5 mins by liquid sc...


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185771
PNG
(CHEMBL3824160)
Show SMILES CC1CCN(CC1)c1nc(ccc1CNC(=O)Nc1ccc(NS(C)(=O)=O)c(F)c1)C(F)(F)F
Show InChI InChI=1S/C21H25F4N5O3S/c1-13-7-9-30(10-8-13)19-14(3-6-18(28-19)21(23,24)25)12-26-20(31)27-15-4-5-17(16(22)11-15)29-34(2,32)33/h3-6,11,13,29H,7-10,12H2,1-2H3,(H2,26,27,31)
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149n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-induced 45Ca2+ uptake incubated for 5 mins by liquid sc...


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185818
PNG
(CHEMBL3823968)
Show SMILES CC1CCN(CC1)c1nc(ccc1CNC(=O)NCc1ccc(CNS(C)(=O)=O)c(F)c1)C(F)(F)F
Show InChI InChI=1S/C23H29F4N5O3S/c1-15-7-9-32(10-8-15)21-18(5-6-20(31-21)23(25,26)27)13-29-22(33)28-12-16-3-4-17(19(24)11-16)14-30-36(2,34)35/h3-6,11,15,30H,7-10,12-14H2,1-2H3,(H2,28,29,33)
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199n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-induced 45Ca2+ uptake incubated for 5 mins by liquid sc...


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185819
PNG
(CHEMBL3823983)
Show SMILES CC1CCN(CC1)c1nc(ccc1CCNC(=O)Nc1ccc(NS(C)(=O)=O)c(F)c1)C(F)(F)F
Show InChI InChI=1S/C22H27F4N5O3S/c1-14-8-11-31(12-9-14)20-15(3-6-19(29-20)22(24,25)26)7-10-27-21(32)28-16-4-5-18(17(23)13-16)30-35(2,33)34/h3-6,13-14,30H,7-12H2,1-2H3,(H2,27,28,32)
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210n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]-resiniferatoxin from human TRPV1 expressed in CHO cells incubated for 60 mins by scintillation counting analysis


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185770
PNG
(CHEMBL3822749)
Show SMILES CC(C(=O)NCc1ccc(nc1N1CCC(C)CC1)C(F)(F)F)c1ccc(CNS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C24H30F4N4O3S/c1-15-8-10-32(11-9-15)22-19(6-7-21(31-22)24(26,27)28)13-29-23(33)16(2)17-4-5-18(20(25)12-17)14-30-36(3,34)35/h4-7,12,15-16,30H,8-11,13-14H2,1-3H3,(H,29,33)
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230n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]-resiniferatoxin from human TRPV1 expressed in CHO cells incubated for 60 mins by scintillation counting analysis


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185818
PNG
(CHEMBL3823968)
Show SMILES CC1CCN(CC1)c1nc(ccc1CNC(=O)NCc1ccc(CNS(C)(=O)=O)c(F)c1)C(F)(F)F
Show InChI InChI=1S/C23H29F4N5O3S/c1-15-7-9-32(10-8-15)21-18(5-6-20(31-21)23(25,26)27)13-29-22(33)28-12-16-3-4-17(19(24)11-16)14-30-36(2,34)35/h3-6,11,15,30H,7-10,12-14H2,1-2H3,(H2,28,29,33)
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410n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]-resiniferatoxin from human TRPV1 expressed in CHO cells incubated for 60 mins by scintillation counting analysis


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185815
PNG
(CHEMBL3822592)
Show SMILES CC1CCN(CC1)c1nc(ccc1CNC(=O)N(c1cccc(C)c1)c1ccc(NS(C)(=O)=O)c(F)c1)C(F)(F)F
Show InChI InChI=1S/C28H31F4N5O3S/c1-18-11-13-36(14-12-18)26-20(7-10-25(34-26)28(30,31)32)17-33-27(38)37(21-6-4-5-19(2)15-21)22-8-9-24(23(29)16-22)35-41(3,39)40/h4-10,15-16,18,35H,11-14,17H2,1-3H3,(H,33,38)
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490n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]-resiniferatoxin from human TRPV1 expressed in CHO cells incubated for 60 mins by scintillation counting analysis


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185815
PNG
(CHEMBL3822592)
Show SMILES CC1CCN(CC1)c1nc(ccc1CNC(=O)N(c1cccc(C)c1)c1ccc(NS(C)(=O)=O)c(F)c1)C(F)(F)F
Show InChI InChI=1S/C28H31F4N5O3S/c1-18-11-13-36(14-12-18)26-20(7-10-25(34-26)28(30,31)32)17-33-27(38)37(21-6-4-5-19(2)15-21)22-8-9-24(23(29)16-22)35-41(3,39)40/h4-10,15-16,18,35H,11-14,17H2,1-3H3,(H,33,38)
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860n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-induced 45Ca2+ uptake preincubated for 30 mins prior to...


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185814
PNG
(CHEMBL3822772)
Show SMILES CC1CCN(CC1)c1nc(ccc1CNC(=O)N(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(F)(F)F
Show InChI InChI=1S/C22H27F4N5O3S/c1-14-8-10-31(11-9-14)20-15(4-7-19(28-20)22(24,25)26)13-27-21(32)30(2)16-5-6-18(17(23)12-16)29-35(3,33)34/h4-7,12,14,29H,8-11,13H2,1-3H3,(H,27,32)
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1.16E+3n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]-resiniferatoxin from human TRPV1 expressed in CHO cells incubated for 60 mins by scintillation counting analysis


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50185815
PNG
(CHEMBL3822592)
Show SMILES CC1CCN(CC1)c1nc(ccc1CNC(=O)N(c1cccc(C)c1)c1ccc(NS(C)(=O)=O)c(F)c1)C(F)(F)F
Show InChI InChI=1S/C28H31F4N5O3S/c1-18-11-13-36(14-12-18)26-20(7-10-25(34-26)28(30,31)32)17-33-27(38)37(21-6-4-5-19(2)15-21)22-8-9-24(23(29)16-22)35-41(3,39)40/h4-10,15-16,18,35H,11-14,17H2,1-3H3,(H,33,38)
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2.20E+3n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-induced 45Ca2+ uptake preincubated for 15 mins prior to...


Bioorg Med Chem Lett 26: 3603-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.010
BindingDB Entry DOI: 10.7270/Q2QC05FT
More data for this
Ligand-Target Pair