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10 similar compounds to monomer 50133817

Compile data set for download or QSAR
Wt: 358.8
BDBM50133809
Wt: 372.8
BDBM50133810
Wt: 344.8
BDBM50133818
Wt: 351.2
BDBM50133821
Wt: 372.8
BDBM50133823
Wt: 366.8
BDBM50133829
Wt: 384.7
BDBM50133830
Wt: 358.8
BDBM50133831
Wt: 398.9
BDBM50133832
Wt: 338.4
BDBM50160041
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 19 hits for monomerid = 50133809,50133810,50133818,50133821,50133823,50133829,50133830,50133831,50133832,50160041   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133810
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES CCC(C)c1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1
Show InChI InChI=1S/C20H25ClN4O/c1-3-15(2)16-6-8-17(9-7-16)23-20(26)25-13-11-24(12-14-25)19-18(21)5-4-10-22-19/h4-10,15H,3,11-14H2,1-2H3,(H,23,26)
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n/an/a 17n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block capsaicin-induced (CAP) activation of the rat VR1 channel in a HEK293 ...


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133810
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES CCC(C)c1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1
Show InChI InChI=1S/C20H25ClN4O/c1-3-15(2)16-6-8-17(9-7-16)23-20(26)25-13-11-24(12-14-25)19-18(21)5-4-10-22-19/h4-10,15H,3,11-14H2,1-2H3,(H,23,26)
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n/an/a 23n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block capsaicin-induced (CAP) activation of the rat VR1 channel in a HEK293 ...


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133831
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES CCCc1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1
Show InChI InChI=1S/C19H23ClN4O/c1-2-4-15-6-8-16(9-7-15)22-19(25)24-13-11-23(12-14-24)18-17(20)5-3-10-21-18/h3,5-10H,2,4,11-14H2,1H3,(H,22,25)
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n/an/a 42n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block capsaicin-induced (CAP) activation of the rat VR1 channel in a HEK293 ...


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133829
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES Clc1cccnc1N1CCN(CC1)C(=O)Nc1ccc2ccccc2c1
Show InChI InChI=1S/C20H19ClN4O/c21-18-6-3-9-22-19(18)24-10-12-25(13-11-24)20(26)23-17-8-7-15-4-1-2-5-16(15)14-17/h1-9,14H,10-13H2,(H,23,26)
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n/an/a 278n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block low pH-induced activation of the rat VR1 channel in a HEK293 cell line


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133832
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES Clc1cccnc1N1CCN(CC1)C(=O)Nc1ccc(cc1)C1CCCCC1
Show InChI InChI=1S/C22H27ClN4O/c23-20-7-4-12-24-21(20)26-13-15-27(16-14-26)22(28)25-19-10-8-18(9-11-19)17-5-2-1-3-6-17/h4,7-12,17H,1-3,5-6,13-16H2,(H,25,28)
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n/an/a 30n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block capsaicin-induced (CAP) activation of the rat VR1 channel in a HEK293 ...


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133821
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES Clc1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1
Show InChI InChI=1S/C16H16Cl2N4O/c17-12-3-5-13(6-4-12)20-16(23)22-10-8-21(9-11-22)15-14(18)2-1-7-19-15/h1-7H,8-11H2,(H,20,23)
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n/an/a 655n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block capsaicin-induced (CAP) activation of the rat VR1 channel in a HEK293 ...


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133823
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES CCCCc1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1
Show InChI InChI=1S/C20H25ClN4O/c1-2-3-5-16-7-9-17(10-8-16)23-20(26)25-14-12-24(13-15-25)19-18(21)6-4-11-22-19/h4,6-11H,2-3,5,12-15H2,1H3,(H,23,26)
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n/an/a 117n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block capsaicin-induced (CAP) activation of the rat VR1 channel in a HEK293 ...


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133830
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1
Show InChI InChI=1S/C17H16ClF3N4O/c18-14-2-1-7-22-15(14)24-8-10-25(11-9-24)16(26)23-13-5-3-12(4-6-13)17(19,20)21/h1-7H,8-11H2,(H,23,26)
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n/an/a 64n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block capsaicin-induced (CAP) activation of the rat VR1 channel in a HEK293 ...


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133818
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES CCc1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1
Show InChI InChI=1S/C18H21ClN4O/c1-2-14-5-7-15(8-6-14)21-18(24)23-12-10-22(11-13-23)17-16(19)4-3-9-20-17/h3-9H,2,10-13H2,1H3,(H,21,24)
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n/an/a 107n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block capsaicin-induced (CAP) activation of the rat VR1 channel in a HEK293 ...


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50160041
PNG
(4-Pyridin-2-yl-piperazine-1-carboxylic acid (4-ter...)
Show SMILES CC(C)(C)c1ccc(NC(=O)N2CCN(CC2)c2ccccn2)cc1
Show InChI InChI=1S/C20H26N4O/c1-20(2,3)16-7-9-17(10-8-16)22-19(25)24-14-12-23(13-15-24)18-6-4-5-11-21-18/h4-11H,12-15H2,1-3H3,(H,22,25)
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n/an/a 150n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro antagonistic activity on VR1 receptor in [Ca2+] influx assay in rat dorsal root ganglion


Bioorg Med Chem Lett 15: 631-4 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.033
BindingDB Entry DOI: 10.7270/Q25T3JZR
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133832
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES Clc1cccnc1N1CCN(CC1)C(=O)Nc1ccc(cc1)C1CCCCC1
Show InChI InChI=1S/C22H27ClN4O/c23-20-7-4-12-24-21(20)26-13-15-27(16-14-26)22(28)25-19-10-8-18(9-11-19)17-5-2-1-3-6-17/h4,7-12,17H,1-3,5-6,13-16H2,(H,25,28)
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n/an/a 92n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block low pH-induced activation of the rat VR1 channel in a HEK293 cell line


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133829
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES Clc1cccnc1N1CCN(CC1)C(=O)Nc1ccc2ccccc2c1
Show InChI InChI=1S/C20H19ClN4O/c21-18-6-3-9-22-19(18)24-10-12-25(13-11-24)20(26)23-17-8-7-15-4-1-2-5-16(15)14-17/h1-9,14H,10-13H2,(H,23,26)
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n/an/a 479n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block capsaicin-induced (CAP) activation of the rat VR1 channel in a HEK293 ...


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133830
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1
Show InChI InChI=1S/C17H16ClF3N4O/c18-14-2-1-7-22-15(14)24-8-10-25(11-9-24)16(26)23-13-5-3-12(4-6-13)17(19,20)21/h1-7H,8-11H2,(H,23,26)
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n/an/a 81n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block low pH-induced activation of the rat VR1 channel in a HEK293 cell line


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133818
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES CCc1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1
Show InChI InChI=1S/C18H21ClN4O/c1-2-14-5-7-15(8-6-14)21-18(24)23-12-10-22(11-13-23)17-16(19)4-3-9-20-17/h3-9H,2,10-13H2,1H3,(H,21,24)
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n/an/a 57n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block low pH-induced activation of the rat VR1 channel in a HEK293 cell line


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133831
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES CCCc1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1
Show InChI InChI=1S/C19H23ClN4O/c1-2-4-15-6-8-16(9-7-15)22-19(25)24-13-11-23(12-14-24)18-17(20)5-3-10-21-18/h3,5-10H,2,4,11-14H2,1H3,(H,22,25)
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n/an/a 73n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block low pH-induced activation of the rat VR1 channel in a HEK293 cell line


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133823
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES CCCCc1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1
Show InChI InChI=1S/C20H25ClN4O/c1-2-3-5-16-7-9-17(10-8-16)23-20(26)25-14-12-24(13-15-25)19-18(21)6-4-11-22-19/h4,6-11H,2-3,5,12-15H2,1H3,(H,23,26)
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n/an/a 203n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block capsaicin-induced (CAP) activation of the rat VR1 channel in a HEK293 ...


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133821
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES Clc1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1
Show InChI InChI=1S/C16H16Cl2N4O/c17-12-3-5-13(6-4-12)20-16(23)22-10-8-21(9-11-22)15-14(18)2-1-7-19-15/h1-7H,8-11H2,(H,20,23)
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n/an/a 2.67E+3n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block low pH-induced activation of the rat VR1 channel in a HEK293 cell line


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133809
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES CC(C)c1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1
Show InChI InChI=1S/C19H23ClN4O/c1-14(2)15-5-7-16(8-6-15)22-19(25)24-12-10-23(11-13-24)18-17(20)4-3-9-21-18/h3-9,14H,10-13H2,1-2H3,(H,22,25)
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n/an/a 17n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block capsaicin-induced (CAP) activation of the rat VR1 channel in a HEK293 ...


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50133809
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES CC(C)c1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1
Show InChI InChI=1S/C19H23ClN4O/c1-14(2)15-5-7-16(8-6-15)22-19(25)24-12-10-23(11-13-24)18-17(20)4-3-9-21-18/h3-9,14H,10-13H2,1-2H3,(H,22,25)
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n/an/a 12n/an/an/an/an/an/a



Purdue Pharma L.P.

Curated by ChEMBL


Assay Description
Vanilloid receptor subtype 1 antagonist activity based on its ability to block capsaicin-induced (CAP) activation of the rat VR1 channel in a HEK293 ...


Bioorg Med Chem Lett 13: 3611-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00759-5
BindingDB Entry DOI: 10.7270/Q28P5ZW4
More data for this
Ligand-Target Pair