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PubMed code 28314510

Compile data set for download or QSAR
Found 66 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 V member 1


(Homo sapiens (Human))		BDBM50256547
PNG
(CHEMBL4104073)
Show SMILES CCC1CCN(CC1)c1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C27H39FN4O3S/c1-7-19-12-14-32(15-13-19)25-21(9-11-24(30-25)27(3,4)5)17-29-26(33)18(2)20-8-10-23(22(28)16-20)31-36(6,34)35/h8-11,16,18-19,31H,7,12-15,17H2,1-6H3,(H,29,33)
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PubMed
 0.100n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256546
PNG
(CHEMBL4105672)
Show SMILES CC(C(=O)NCc1ccc(nc1N1CCC(Cc2ccccc2)CC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C32H41FN4O3S/c1-22(25-11-13-28(27(33)20-25)36-41(5,39)40)31(38)34-21-26-12-14-29(32(2,3)4)35-30(26)37-17-15-24(16-18-37)19-23-9-7-6-8-10-23/h6-14,20,22,24,36H,15-19,21H2,1-5H3,(H,34,38)
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PubMed
 0.300n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256581
PNG
(CHEMBL4078240)
Show SMILES CC(C(=O)NCc1ccc(nc1-c1ccc(F)cc1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C26H29F2N3O3S/c1-16(18-8-12-22(21(28)14-18)31-35(5,33)34)25(32)29-15-19-9-13-23(26(2,3)4)30-24(19)17-6-10-20(27)11-7-17/h6-14,16,31H,15H2,1-5H3,(H,29,32)
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 0.300n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256552
PNG
(CHEMBL4102090)
Show SMILES CCCCCCOc1cc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C27H39FN2O4S/c1-7-8-9-10-15-34-25-17-22(27(3,4)5)13-11-21(25)18-29-26(31)19(2)20-12-14-24(23(28)16-20)30-35(6,32)33/h11-14,16-17,19,30H,7-10,15,18H2,1-6H3,(H,29,31)
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PubMed
 0.5n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256624
PNG
(CHEMBL4070760)
Show SMILES CC(C)COc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C24H34FN3O4S/c1-15(2)14-32-23-18(9-11-21(27-23)24(4,5)6)13-26-22(29)16(3)17-8-10-20(19(25)12-17)28-33(7,30)31/h8-12,15-16,28H,13-14H2,1-7H3,(H,26,29)
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 0.600n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256657
PNG
(CHEMBL4093420)
Show SMILES CC(C)CCOc1cc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C26H37FN2O4S/c1-17(2)12-13-33-24-15-21(26(4,5)6)10-8-20(24)16-28-25(30)18(3)19-9-11-23(22(27)14-19)29-34(7,31)32/h8-11,14-15,17-18,29H,12-13,16H2,1-7H3,(H,28,30)
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 0.600n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256577
PNG
(CHEMBL4070600)
Show SMILES CC(C(=O)NCc1ccc(cc1N1CCC(C)CC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C27H38FN3O3S/c1-18-11-13-31(14-12-18)25-16-22(27(3,4)5)9-7-21(25)17-29-26(32)19(2)20-8-10-24(23(28)15-20)30-35(6,33)34/h7-10,15-16,18-19,30H,11-14,17H2,1-6H3,(H,29,32)
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 0.700n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256626
PNG
(CHEMBL4061052)
Show SMILES CCCCCOc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C25H36FN3O4S/c1-7-8-9-14-33-24-19(11-13-22(28-24)25(3,4)5)16-27-23(30)17(2)18-10-12-21(20(26)15-18)29-34(6,31)32/h10-13,15,17,29H,7-9,14,16H2,1-6H3,(H,27,30)
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 0.800n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256605
PNG
(CHEMBL4104241)
Show SMILES CC(C(=O)NCc1ccc(nc1OCc1ccc(F)cc1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C27H31F2N3O4S/c1-17(19-8-12-23(22(29)14-19)32-37(5,34)35)25(33)30-15-20-9-13-24(27(2,3)4)31-26(20)36-16-18-6-10-21(28)11-7-18/h6-14,17,32H,15-16H2,1-5H3,(H,30,33)
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 0.800n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256647
PNG
(CHEMBL4091637)
Show SMILES CC(C)CCOc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C25H36FN3O4S/c1-16(2)12-13-33-24-19(9-11-22(28-24)25(4,5)6)15-27-23(30)17(3)18-8-10-21(20(26)14-18)29-34(7,31)32/h8-11,14,16-17,29H,12-13,15H2,1-7H3,(H,27,30)
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 0.800n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256555
PNG
(CHEMBL4096979)
Show SMILES CC(C(=O)NCc1ccc(cc1N1CCN(CC1)c1ccccc1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C31H39FN4O3S/c1-22(23-12-14-28(27(32)19-23)34-40(5,38)39)30(37)33-21-24-11-13-25(31(2,3)4)20-29(24)36-17-15-35(16-18-36)26-9-7-6-8-10-26/h6-14,19-20,22,34H,15-18,21H2,1-5H3,(H,33,37)
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 0.800n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256658
PNG
(CHEMBL4067830)
Show SMILES CC(C(=O)NCc1ccc(nc1N1CCCCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C26H37FN4O3S/c1-18(19-10-12-22(21(27)16-19)30-35(5,33)34)25(32)28-17-20-11-13-23(26(2,3)4)29-24(20)31-14-8-6-7-9-15-31/h10-13,16,18,30H,6-9,14-15,17H2,1-5H3,(H,28,32)
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 0.900n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256627
PNG
(CHEMBL4089226)
Show SMILES CCCCOc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C24H34FN3O4S/c1-7-8-13-32-23-18(10-12-21(27-23)24(3,4)5)15-26-22(29)16(2)17-9-11-20(19(25)14-17)28-33(6,30)31/h9-12,14,16,28H,7-8,13,15H2,1-6H3,(H,26,29)
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 0.900n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256580
PNG
(CHEMBL4083611)
Show SMILES CCCCN(C)c1cc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C26H38FN3O3S/c1-8-9-14-30(6)24-16-21(26(3,4)5)12-10-20(24)17-28-25(31)18(2)19-11-13-23(22(27)15-19)29-34(7,32)33/h10-13,15-16,18,29H,8-9,14,17H2,1-7H3,(H,28,31)
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 1n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256549
PNG
(CHEMBL4089039)
Show SMILES CC(C(=O)NCc1ccc(nc1N1CCCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C25H35FN4O3S/c1-17(18-9-11-21(20(26)15-18)29-34(5,32)33)24(31)27-16-19-10-12-22(25(2,3)4)28-23(19)30-13-7-6-8-14-30/h9-12,15,17,29H,6-8,13-14,16H2,1-5H3,(H,27,31)
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 1.10n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256551
PNG
(CHEMBL4097698)
Show SMILES CCCCN(C)c1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C25H37FN4O3S/c1-8-9-14-30(6)23-19(11-13-22(28-23)25(3,4)5)16-27-24(31)17(2)18-10-12-21(20(26)15-18)29-34(7,32)33/h10-13,15,17,29H,8-9,14,16H2,1-7H3,(H,27,31)
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 1.20n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256550
PNG
(CHEMBL4095354)
Show SMILES CC(C(=O)NCc1ccc(nc1N1CCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C24H33FN4O3S/c1-16(17-8-10-20(19(25)14-17)28-33(5,31)32)23(30)26-15-18-9-11-21(24(2,3)4)27-22(18)29-12-6-7-13-29/h8-11,14,16,28H,6-7,12-13,15H2,1-5H3,(H,26,30)
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 1.20n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256554
PNG
(CHEMBL4064110)
Show SMILES CCCCOc1cc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C25H35FN2O4S/c1-7-8-13-32-23-15-20(25(3,4)5)11-9-19(23)16-27-24(29)17(2)18-10-12-22(21(26)14-18)28-33(6,30)31/h9-12,14-15,17,28H,7-8,13,16H2,1-6H3,(H,27,29)
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 1.40n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256609
PNG
(CHEMBL4076446)
Show SMILES CC(C(=O)NCc1ccc(nc1OC1CCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C25H34FN3O4S/c1-16(17-10-12-21(20(26)14-17)29-34(5,31)32)23(30)27-15-18-11-13-22(25(2,3)4)28-24(18)33-19-8-6-7-9-19/h10-14,16,19,29H,6-9,15H2,1-5H3,(H,27,30)
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 1.5n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256598
PNG
(CHEMBL4059664)
Show SMILES CCCCCCSc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C26H38FN3O3S2/c1-7-8-9-10-15-34-25-20(12-14-23(29-25)26(3,4)5)17-28-24(31)18(2)19-11-13-22(21(27)16-19)30-35(6,32)33/h11-14,16,18,30H,7-10,15,17H2,1-6H3,(H,28,31)
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 1.5n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256628
PNG
(CHEMBL4069736)
Show SMILES CCCOc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C23H32FN3O4S/c1-7-12-31-22-17(9-11-20(26-22)23(3,4)5)14-25-21(28)15(2)16-8-10-19(18(24)13-16)27-32(6,29)30/h8-11,13,15,27H,7,12,14H2,1-6H3,(H,25,28)
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 1.70n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256543
PNG
(CHEMBL4072701)
Show SMILES CC(C(=O)NCc1ccc(cc1OC1CCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C26H35FN2O4S/c1-17(18-11-13-23(22(27)14-18)29-34(5,31)32)25(30)28-16-19-10-12-20(26(2,3)4)15-24(19)33-21-8-6-7-9-21/h10-15,17,21,29H,6-9,16H2,1-5H3,(H,28,30)
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 1.80n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256548
PNG
(CHEMBL4085410)
Show SMILES CC(C(=O)NCc1ccc(nc1N1CCC(C)CC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C26H37FN4O3S/c1-17-11-13-31(14-12-17)24-20(8-10-23(29-24)26(3,4)5)16-28-25(32)18(2)19-7-9-22(21(27)15-19)30-35(6,33)34/h7-10,15,17-18,30H,11-14,16H2,1-6H3,(H,28,32)
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 1.90n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256631
PNG
(CHEMBL4073205)
Show SMILES CC(C(=O)NCc1ccc(cc1N1CCCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C26H36FN3O3S/c1-18(19-10-12-23(22(27)15-19)29-34(5,32)33)25(31)28-17-20-9-11-21(26(2,3)4)16-24(20)30-13-7-6-8-14-30/h9-12,15-16,18,29H,6-8,13-14,17H2,1-5H3,(H,28,31)
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 1.90n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256582
PNG
(CHEMBL4069267)
Show SMILES CCCCCc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C25H36FN3O3S/c1-7-8-9-10-21-19(12-14-23(28-21)25(3,4)5)16-27-24(30)17(2)18-11-13-22(20(26)15-18)29-33(6,31)32/h11-15,17,29H,7-10,16H2,1-6H3,(H,27,30)
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 1.90n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256545
PNG
(CHEMBL4101174)
Show SMILES CC(C)COc1cc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C25H35FN2O4S/c1-16(2)15-32-23-13-20(25(4,5)6)10-8-19(23)14-27-24(29)17(3)18-9-11-22(21(26)12-18)28-33(7,30)31/h8-13,16-17,28H,14-15H2,1-7H3,(H,27,29)
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 2.10n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256553
PNG
(CHEMBL4077828)
Show SMILES CCCCCOc1cc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C26H37FN2O4S/c1-7-8-9-14-33-24-16-21(26(3,4)5)12-10-20(24)17-28-25(30)18(2)19-11-13-23(22(27)15-19)29-34(6,31)32/h10-13,15-16,18,29H,7-9,14,17H2,1-6H3,(H,28,30)
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 2.20n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256625
PNG
(CHEMBL4064288)
Show SMILES CC(C)Oc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C23H32FN3O4S/c1-14(2)31-22-17(9-11-20(26-22)23(4,5)6)13-25-21(28)15(3)16-8-10-19(18(24)12-16)27-32(7,29)30/h8-12,14-15,27H,13H2,1-7H3,(H,25,28)
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 2.30n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256670
PNG
(CHEMBL4061913)
Show SMILES CCCN(CCC)c1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C26H39FN4O3S/c1-8-14-31(15-9-2)24-20(11-13-23(29-24)26(4,5)6)17-28-25(32)18(3)19-10-12-22(21(27)16-19)30-35(7,33)34/h10-13,16,18,30H,8-9,14-15,17H2,1-7H3,(H,28,32)
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 2.5n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256594
PNG
(CHEMBL4096530)
Show SMILES CC(C(=O)NCc1ccc(nc1SC1CCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C25H34FN3O3S2/c1-16(17-10-12-21(20(26)14-17)29-34(5,31)32)23(30)27-15-18-11-13-22(25(2,3)4)28-24(18)33-19-8-6-7-9-19/h10-14,16,19,29H,6-9,15H2,1-5H3,(H,27,30)
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 2.5n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256608
PNG
(CHEMBL4103769)
Show SMILES CC(C(=O)NCc1ccc(nc1OC1CCCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C26H36FN3O4S/c1-17(18-11-13-22(21(27)15-18)30-35(5,32)33)24(31)28-16-19-12-14-23(26(2,3)4)29-25(19)34-20-9-7-6-8-10-20/h11-15,17,20,30H,6-10,16H2,1-5H3,(H,28,31)
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 2.5n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256648
PNG
(CHEMBL4081355)
Show SMILES CCCCCCOc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C26H38FN3O4S/c1-7-8-9-10-15-34-25-20(12-14-23(29-25)26(3,4)5)17-28-24(31)18(2)19-11-13-22(21(27)16-19)30-35(6,32)33/h11-14,16,18,30H,7-10,15,17H2,1-6H3,(H,28,31)
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 2.70n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256528
PNG
(CHEMBL4087871)
Show SMILES CCCCCc1cc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C26H37FN2O3S/c1-7-8-9-10-20-15-22(26(3,4)5)13-11-21(20)17-28-25(30)18(2)19-12-14-24(23(27)16-19)29-33(6,31)32/h11-16,18,29H,7-10,17H2,1-6H3,(H,28,30)
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 2.80n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256656
PNG
(CHEMBL4098702)
Show SMILES CC(C(=O)NCc1ccc(cc1OCc1ccccc1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C28H33FN2O4S/c1-19(21-12-14-25(24(29)15-21)31-36(5,33)34)27(32)30-17-22-11-13-23(28(2,3)4)16-26(22)35-18-20-9-7-6-8-10-20/h6-16,19,31H,17-18H2,1-5H3,(H,30,32)
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 2.90n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256599
PNG
(CHEMBL4095591)
Show SMILES CCCCCSc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C25H36FN3O3S2/c1-7-8-9-14-33-24-19(11-13-22(28-24)25(3,4)5)16-27-23(30)17(2)18-10-12-21(20(26)15-18)29-34(6,31)32/h10-13,15,17,29H,7-9,14,16H2,1-6H3,(H,27,30)
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 3.10n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256632
PNG
(CHEMBL4102515)
Show SMILES CC(C(=O)NCc1ccc(nc1C1CCCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C26H36FN3O3S/c1-17(19-11-13-22(21(27)15-19)30-34(5,32)33)25(31)28-16-20-12-14-23(26(2,3)4)29-24(20)18-9-7-6-8-10-18/h11-15,17-18,30H,6-10,16H2,1-5H3,(H,28,31)
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 3.10n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256600
PNG
(CHEMBL4076319)
Show SMILES CCCCSc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C24H34FN3O3S2/c1-7-8-13-32-23-18(10-12-21(27-23)24(3,4)5)15-26-22(29)16(2)17-9-11-20(19(25)14-17)28-33(6,30)31/h9-12,14,16,28H,7-8,13,15H2,1-6H3,(H,26,29)
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 3.20n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256635
PNG
(CHEMBL4070318)
Show SMILES C[C@H](C(=O)NCc1ccc(nc1SC1CCCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1 |r|
Show InChI InChI=1S/C26H36FN3O3S2/c1-17(18-11-13-22(21(27)15-18)30-35(5,32)33)24(31)28-16-19-12-14-23(26(2,3)4)29-25(19)34-20-9-7-6-8-10-20/h11-15,17,20,30H,6-10,16H2,1-5H3,(H,28,31)/t17-/m0/s1
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 3.40n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256584
PNG
(CHEMBL4077270)
Show SMILES CC(C(=O)NCc1ccc(nc1SCc1ccc(Cl)cc1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C27H31ClFN3O3S2/c1-17(19-8-12-23(22(29)14-19)32-37(5,34)35)25(33)30-15-20-9-13-24(27(2,3)4)31-26(20)36-16-18-6-10-21(28)11-7-18/h6-14,17,32H,15-16H2,1-5H3,(H,30,33)
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 3.40n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256583
PNG
(CHEMBL4075950)
Show SMILES COc1ccc(CSc2nc(ccc2CNC(=O)C(C)c2ccc(NS(C)(=O)=O)c(F)c2)C(C)(C)C)cc1
Show InChI InChI=1S/C28H34FN3O4S2/c1-18(20-9-13-24(23(29)15-20)32-38(6,34)35)26(33)30-16-21-10-14-25(28(2,3)4)31-27(21)37-17-19-7-11-22(36-5)12-8-19/h7-15,18,32H,16-17H2,1-6H3,(H,30,33)
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 3.5n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256533
PNG
(CHEMBL4096492)
Show SMILES CC(C(=O)NCc1ccc(cc1OCc1ccc(F)cc1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C28H32F2N2O4S/c1-18(20-9-13-25(24(30)14-20)32-37(5,34)35)27(33)31-16-21-8-10-22(28(2,3)4)15-26(21)36-17-19-6-11-23(29)12-7-19/h6-15,18,32H,16-17H2,1-5H3,(H,31,33)
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 3.80n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256544
PNG
(CHEMBL4083176)
Show SMILES CC(C(=O)NCc1ccc(cc1OCC(C)(C)C)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C26H37FN2O4S/c1-17(18-10-12-22(21(27)13-18)29-34(8,31)32)24(30)28-15-19-9-11-20(26(5,6)7)14-23(19)33-16-25(2,3)4/h9-14,17,29H,15-16H2,1-8H3,(H,28,30)
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 3.80n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256633
PNG
(CHEMBL4099896)
Show SMILES CC(C(=O)NCc1ccc(nc1SCc1ccccc1Cl)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C27H31ClFN3O3S2/c1-17(18-10-12-23(22(29)14-18)32-37(5,34)35)25(33)30-15-19-11-13-24(27(2,3)4)31-26(19)36-16-20-8-6-7-9-21(20)28/h6-14,17,32H,15-16H2,1-5H3,(H,30,33)
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 3.80n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256585
PNG
(CHEMBL4080952)
Show SMILES CC(C(=O)NCc1ccc(nc1SCc1ccccc1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C27H32FN3O3S2/c1-18(20-11-13-23(22(28)15-20)31-36(5,33)34)25(32)29-16-21-12-14-24(27(2,3)4)30-26(21)35-17-19-9-7-6-8-10-19/h6-15,18,31H,16-17H2,1-5H3,(H,29,32)
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 4n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256597
PNG
(CHEMBL4061629)
Show SMILES CC(C(=O)NCc1ccc(nc1SCC(F)(F)F)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C22H27F4N3O3S2/c1-13(14-6-8-17(16(23)10-14)29-34(5,31)32)19(30)27-11-15-7-9-18(21(2,3)4)28-20(15)33-12-22(24,25)26/h6-10,13,29H,11-12H2,1-5H3,(H,27,30)
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 4.10n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256630
PNG
(CHEMBL4085682)
Show SMILES CCCOc1cc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C24H33FN2O4S/c1-7-12-31-22-14-19(24(3,4)5)10-8-18(22)15-26-23(28)16(2)17-9-11-21(20(25)13-17)27-32(6,29)30/h8-11,13-14,16,27H,7,12,15H2,1-6H3,(H,26,28)
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 4.40n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256606
PNG
(CHEMBL4069604)
Show SMILES CC(C(=O)NCc1ccc(nc1OCc1ccccc1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C27H32FN3O4S/c1-18(20-11-13-23(22(28)15-20)31-36(5,33)34)25(32)29-16-21-12-14-24(27(2,3)4)30-26(21)35-17-19-9-7-6-8-10-19/h6-15,18,31H,16-17H2,1-5H3,(H,29,32)
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 4.40n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256646
PNG
(CHEMBL4096513)
Show SMILES COCCCOc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C24H34FN3O5S/c1-16(17-8-10-20(19(25)14-17)28-34(6,30)31)22(29)26-15-18-9-11-21(24(2,3)4)27-23(18)33-13-7-12-32-5/h8-11,14,16,28H,7,12-13,15H2,1-6H3,(H,26,29)
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 5.60n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256644
PNG
(CHEMBL4083437)
Show SMILES CC(C)CCSc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C25H36FN3O3S2/c1-16(2)12-13-33-24-19(9-11-22(28-24)25(4,5)6)15-27-23(30)17(3)18-8-10-21(20(26)14-18)29-34(7,31)32/h8-11,14,16-17,29H,12-13,15H2,1-7H3,(H,27,30)
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 5.90n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256655
PNG
(CHEMBL4079990)
Show SMILES C[C@H](C(=O)NCc1ccc(cc1SC1CCCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1 |r|
Show InChI InChI=1S/C27H37FN2O3S2/c1-18(19-12-14-24(23(28)15-19)30-35(5,32)33)26(31)29-17-20-11-13-21(27(2,3)4)16-25(20)34-22-9-7-6-8-10-22/h11-16,18,22,30H,6-10,17H2,1-5H3,(H,29,31)/t18-/m0/s1
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 6n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256645
PNG
(CHEMBL4087890)
Show SMILES COc1cccc(COc2nc(ccc2CNC(=O)C(C)c2ccc(NS(C)(=O)=O)c(F)c2)C(C)(C)C)c1
Show InChI InChI=1S/C28H34FN3O5S/c1-18(20-10-12-24(23(29)15-20)32-38(6,34)35)26(33)30-16-21-11-13-25(28(2,3)4)31-27(21)37-17-19-8-7-9-22(14-19)36-5/h7-15,18,32H,16-17H2,1-6H3,(H,30,33)
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 6n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256578
PNG
(CHEMBL4093885)
Show SMILES CC(C(=O)NCc1ccc(cc1N1CCCCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C27H38FN3O3S/c1-19(20-11-13-24(23(28)16-20)30-35(5,33)34)26(32)29-18-21-10-12-22(27(2,3)4)17-25(21)31-14-8-6-7-9-15-31/h10-13,16-17,19,30H,6-9,14-15,18H2,1-5H3,(H,29,32)
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 6.20n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256532
PNG
(CHEMBL4069261)
Show SMILES CCCCSc1cc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C25H35FN2O3S2/c1-7-8-13-32-23-15-20(25(3,4)5)11-9-19(23)16-27-24(29)17(2)18-10-12-22(21(26)14-18)28-33(6,30)31/h9-12,14-15,17,28H,7-8,13,16H2,1-6H3,(H,27,29)
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 6.70n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256531
PNG
(CHEMBL4104231)
Show SMILES CC(C(=O)NCc1ccc(cc1SC1CCCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C27H37FN2O3S2/c1-18(19-12-14-24(23(28)15-19)30-35(5,32)33)26(31)29-17-20-11-13-21(27(2,3)4)16-25(20)34-22-9-7-6-8-10-22/h11-16,18,22,30H,6-10,17H2,1-5H3,(H,29,31)
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 7.40n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256534
PNG
(CHEMBL4071681)
Show SMILES CC(C(=O)NCc1ccc(cc1OC1CCCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C27H37FN2O4S/c1-18(19-12-14-24(23(28)15-19)30-35(5,32)33)26(31)29-17-20-11-13-21(27(2,3)4)16-25(20)34-22-9-7-6-8-10-22/h11-16,18,22,30H,6-10,17H2,1-5H3,(H,29,31)
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 8.10n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256579
PNG
(CHEMBL4101614)
Show SMILES CC(C(=O)NCc1ccc(cc1N1CCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C25H34FN3O3S/c1-17(18-9-11-22(21(26)14-18)28-33(5,31)32)24(30)27-16-19-8-10-20(25(2,3)4)15-23(19)29-12-6-7-13-29/h8-11,14-15,17,28H,6-7,12-13,16H2,1-5H3,(H,27,30)
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 8.10n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256587
PNG
(CHEMBL4091248)
Show SMILES CC(C(=O)NCc1ccc(nc1SC1CCCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C26H36FN3O3S2/c1-17(18-11-13-22(21(27)15-18)30-35(5,32)33)24(31)28-16-19-12-14-23(26(2,3)4)29-25(19)34-20-9-7-6-8-10-20/h11-15,17,20,30H,6-10,16H2,1-5H3,(H,28,31)
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 8.5n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256654
PNG
(CHEMBL4075164)
Show SMILES CC(C(=O)NCc1ccc(cc1C1CCCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C27H37FN2O3S/c1-18(20-12-14-25(24(28)15-20)30-34(5,32)33)26(31)29-17-21-11-13-22(27(2,3)4)16-23(21)19-9-7-6-8-10-19/h11-16,18-19,30H,6-10,17H2,1-5H3,(H,29,31)
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 9.80n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256629
PNG
(CHEMBL4062953)
Show SMILES COc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C21H28FN3O4S/c1-13(14-7-9-17(16(22)11-14)25-30(6,27)28)19(26)23-12-15-8-10-18(21(2,3)4)24-20(15)29-5/h7-11,13,25H,12H2,1-6H3,(H,23,26)
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 14n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256649
PNG
(CHEMBL4096926)
Show SMILES CCOc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C22H30FN3O4S/c1-7-30-21-16(9-11-19(25-21)22(3,4)5)13-24-20(27)14(2)15-8-10-18(17(23)12-15)26-31(6,28)29/h8-12,14,26H,7,13H2,1-6H3,(H,24,27)
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 15n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256595
PNG
(CHEMBL4088544)
Show SMILES CC(C(=O)NCc1ccc(nc1SCCCN1CCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C27H39FN4O3S2/c1-19(20-9-11-23(22(28)17-20)31-37(5,34)35)25(33)29-18-21-10-12-24(27(2,3)4)30-26(21)36-16-8-15-32-13-6-7-14-32/h9-12,17,19,31H,6-8,13-16,18H2,1-5H3,(H,29,33)
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 17n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256607
PNG
(CHEMBL4071190)
Show SMILES CCOCCOc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C24H34FN3O5S/c1-7-32-12-13-33-23-18(9-11-21(27-23)24(3,4)5)15-26-22(29)16(2)17-8-10-20(19(25)14-17)28-34(6,30)31/h8-11,14,16,28H,7,12-13,15H2,1-6H3,(H,26,29)
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 24n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256586
PNG
(CHEMBL4098985)
Show SMILES C[C@@H](C(=O)NCc1ccc(nc1SC1CCCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1 |r|
Show InChI InChI=1S/C26H36FN3O3S2/c1-17(18-11-13-22(21(27)15-18)30-35(5,32)33)24(31)28-16-19-12-14-23(26(2,3)4)29-25(19)34-20-9-7-6-8-10-20/h11-15,17,20,30H,6-10,16H2,1-5H3,(H,28,31)/t17-/m1/s1
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 36n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256596
PNG
(CHEMBL4066502)
Show SMILES CC(C(=O)NCc1ccc(nc1SCCCN(C)C)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C25H37FN4O3S2/c1-17(18-9-11-21(20(26)15-18)29-35(7,32)33)23(31)27-16-19-10-12-22(25(2,3)4)28-24(19)34-14-8-13-30(5)6/h9-12,15,17,29H,8,13-14,16H2,1-7H3,(H,27,31)
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 52n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256530
PNG
(CHEMBL4076317)
Show SMILES C[C@@H](C(=O)NCc1ccc(cc1SC1CCCCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1 |r|
Show InChI InChI=1S/C27H37FN2O3S2/c1-18(19-12-14-24(23(28)15-19)30-35(5,32)33)26(31)29-17-20-11-13-21(27(2,3)4)16-25(20)34-22-9-7-6-8-10-22/h11-16,18,22,30H,6-10,17H2,1-5H3,(H,29,31)/t18-/m1/s1
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 89n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))		BDBM50256637
PNG
(CHEMBL4069297)
Show SMILES CC(C(=O)NCc1ccc(nc1SCCCN1CCOCC1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C27H39FN4O4S2/c1-19(20-7-9-23(22(28)17-20)31-38(5,34)35)25(33)29-18-21-8-10-24(27(2,3)4)30-26(21)37-16-6-11-32-12-14-36-15-13-32/h7-10,17,19,31H,6,11-16,18H2,1-5H3,(H,29,33)
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 112n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, Research Institute of Pharmaceutical Sciences, College of Pharmacy, Seoul National University, Seoul 08826, Republic of Korea.

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin induced calcium influx pretreated for 6 mins followed...

Bioorg Med Chem 25: 2451-2462 (2017)


Article DOI: 10.1016/j.bmc.2017.03.004
BindingDB Entry DOI: 10.7270/Q2BZ68HP
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%