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PubMed code 26216015

Compile data set for download or QSAR
Found 72 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
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50072394
PNG
(1-[3-(1H-4-imidazolyl)-2-(5-oxotetrahydro-1H-2-pyr...)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1 |r|
Show InChI InChI=1S/C16H22N6O4/c17-14(24)12-2-1-5-22(12)16(26)11(6-9-7-18-8-19-9)21-15(25)10-3-4-13(23)20-10/h7-8,10-12H,1-6H2,(H2,17,24)(H,18,19)(H,20,23)(H,21,25)/t10-,11-,12-/m0/s1
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n/an/a 2.60n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50072394
PNG
(1-[3-(1H-4-imidazolyl)-2-(5-oxotetrahydro-1H-2-pyr...)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1 |r|
Show InChI InChI=1S/C16H22N6O4/c17-14(24)12-2-1-5-22(12)16(26)11(6-9-7-18-8-19-9)21-15(25)10-3-4-13(23)20-10/h7-8,10-12H,1-6H2,(H2,17,24)(H,18,19)(H,20,23)(H,21,25)/t10-,11-,12-/m0/s1
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n/an/a 7n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109025
PNG
(CHEMBL3600444)
Show SMILES Cc1cnc(cn1)C(=O)N[C@@H](Cc1nc(I)n(Cc2ccccc2)c1I)C(=O)N1CCC[C@H]1C(N)=O |r|
Show InChI InChI=1S/C24H25I2N7O3/c1-14-11-29-18(12-28-14)22(35)30-17(23(36)32-9-5-8-19(32)21(27)34)10-16-20(25)33(24(26)31-16)13-15-6-3-2-4-7-15/h2-4,6-7,11-12,17,19H,5,8-10,13H2,1H3,(H2,27,34)(H,30,35)/t17-,19-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109027
PNG
(CHEMBL3600446)
Show SMILES CCCc1nc(C[C@H](NC(=O)c2cnccn2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109028
PNG
(CHEMBL3600447)
Show SMILES CCCc1nc(C[C@H](NC(=O)c2cnc(C)cn2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109039
PNG
(CHEMBL3600454)
Show SMILES Cc1cnc(cn1)C(=O)N[C@@H](Cc1nc(Br)[nH]c1Br)C(=O)N1CCC[C@H]1C(N)=O |r|
Show InChI InChI=1S/C17H19Br2N7O3/c1-8-6-22-11(7-21-8)15(28)23-10(5-9-13(18)25-17(19)24-9)16(29)26-4-2-3-12(26)14(20)27/h6-7,10,12H,2-5H2,1H3,(H2,20,27)(H,23,28)(H,24,25)/t10-,12-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109018
PNG
(CHEMBL3601784)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(I)[nH]c1I)NC(=O)c1cnccn1 |r|
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109022
PNG
(CHEMBL3601785)
Show SMILES Cn1cnc(C[C@H](NC(=O)c2cnccn2)C(=O)N2CCC[C@H]2C(N)=O)c1Br |r|
Show InChI InChI=1S/C17H20BrN7O3/c1-24-9-22-10(14(24)18)7-11(23-16(27)12-8-20-4-5-21-12)17(28)25-6-2-3-13(25)15(19)26/h4-5,8-9,11,13H,2-3,6-7H2,1H3,(H2,19,26)(H,23,27)/t11-,13-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109023
PNG
(CHEMBL3601786)
Show SMILES CCn1c(I)nc(C[C@H](NC(=O)c2cnccn2)C(=O)N2CCC[C@H]2C(N)=O)c1I |r|
Show InChI InChI=1S/C18H21I2N7O3/c1-2-26-14(19)10(25-18(26)20)8-11(24-16(29)12-9-22-5-6-23-12)17(30)27-7-3-4-13(27)15(21)28/h5-6,9,11,13H,2-4,7-8H2,1H3,(H2,21,28)(H,24,29)/t11-,13-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109026
PNG
(CHEMBL3600445)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(I)n(Cc2ccccc2)c1I)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C23H23I2N7O3/c24-19-15(30-23(25)32(19)13-14-5-2-1-3-6-14)11-16(29-21(34)17-12-27-8-9-28-17)22(35)31-10-4-7-18(31)20(26)33/h1-3,5-6,8-9,12,16,18H,4,7,10-11,13H2,(H2,26,33)(H,29,34)/t16-,18-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109035
PNG
(CHEMBL3600450)
Show SMILES CC(C)c1nc(C[C@H](NC(=O)[C@H]2CCCCN2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
Show InChI InChI=1S/C20H32N6O3/c1-12(2)18-23-11-13(24-18)10-15(25-19(28)14-6-3-4-8-22-14)20(29)26-9-5-7-16(26)17(21)27/h11-12,14-16,22H,3-10H2,1-2H3,(H2,21,27)(H,23,24)(H,25,28)/t14-,15+,16+/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109040
PNG
(CHEMBL3601782)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc[nH]c1Br)NC(=O)c1nccnc1N |r|
Show InChI InChI=1S/C16H19BrN8O3/c17-12-8(22-7-23-12)6-9(16(28)25-5-1-2-10(25)14(19)26)24-15(27)11-13(18)21-4-3-20-11/h3-4,7,9-10H,1-2,5-6H2,(H2,18,21)(H2,19,26)(H,22,23)(H,24,27)/t9-,10-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109038
PNG
(CHEMBL3600453)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(Br)[nH]c1Br)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C16H17Br2N7O3/c17-12-8(23-16(18)24-12)6-9(22-14(27)10-7-20-3-4-21-10)15(28)25-5-1-2-11(25)13(19)26/h3-4,7,9,11H,1-2,5-6H2,(H2,19,26)(H,22,27)(H,23,24)/t9-,11-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109033
PNG
(CHEMBL3600448)
Show SMILES CCCc1nc(C[C@H](NC(=O)c2nccnc2N)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
Show InChI InChI=1S/C19H26N8O3/c1-2-4-14-24-10-11(25-14)9-12(19(30)27-8-3-5-13(27)17(21)28)26-18(29)15-16(20)23-7-6-22-15/h6-7,10,12-13H,2-5,8-9H2,1H3,(H2,20,23)(H2,21,28)(H,24,25)(H,26,29)/t12-,13-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109027
PNG
(CHEMBL3600446)
Show SMILES CCCc1nc(C[C@H](NC(=O)c2cnccn2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109017
PNG
(CHEMBL3601783)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(Br)[nH]c1Br)NC(=O)c1nccnc1N |r|
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109037
PNG
(CHEMBL3600452)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc[nH]c1Br)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C16H18BrN7O3/c17-13-9(21-8-22-13)6-10(23-15(26)11-7-19-3-4-20-11)16(27)24-5-1-2-12(24)14(18)25/h3-4,7-8,10,12H,1-2,5-6H2,(H2,18,25)(H,21,22)(H,23,26)/t10-,12-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109041
PNG
(CHEMBL3601781)
Show SMILES Cc1cnc(cn1)C(=O)N[C@@H](Cc1nc[nH]c1Br)C(=O)N1CCC[C@H]1C(N)=O |r|
Show InChI InChI=1S/C17H20BrN7O3/c1-9-6-21-12(7-20-9)16(27)24-11(5-10-14(18)23-8-22-10)17(28)25-4-2-3-13(25)15(19)26/h6-8,11,13H,2-5H2,1H3,(H2,19,26)(H,22,23)(H,24,27)/t11-,13-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109036
PNG
(CHEMBL3600451)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc[nH]c1Cl)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C16H18ClN7O3/c17-13-9(21-8-22-13)6-10(23-15(26)11-7-19-3-4-20-11)16(27)24-5-1-2-12(24)14(18)25/h3-4,7-8,10,12H,1-2,5-6H2,(H2,18,25)(H,21,22)(H,23,26)/t10-,12-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109035
PNG
(CHEMBL3600450)
Show SMILES CC(C)c1nc(C[C@H](NC(=O)[C@H]2CCCCN2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
Show InChI InChI=1S/C20H32N6O3/c1-12(2)18-23-11-13(24-18)10-15(25-19(28)14-6-3-4-8-22-14)20(29)26-9-5-7-16(26)17(21)27/h11-12,14-16,22H,3-10H2,1-2H3,(H2,21,27)(H,23,24)(H,25,28)/t14-,15+,16+/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109025
PNG
(CHEMBL3600444)
Show SMILES Cc1cnc(cn1)C(=O)N[C@@H](Cc1nc(I)n(Cc2ccccc2)c1I)C(=O)N1CCC[C@H]1C(N)=O |r|
Show InChI InChI=1S/C24H25I2N7O3/c1-14-11-29-18(12-28-14)22(35)30-17(23(36)32-9-5-8-19(32)21(27)34)10-16-20(25)33(24(26)31-16)13-15-6-3-2-4-7-15/h2-4,6-7,11-12,17,19H,5,8-10,13H2,1H3,(H2,27,34)(H,30,35)/t17-,19-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109028
PNG
(CHEMBL3600447)
Show SMILES CCCc1nc(C[C@H](NC(=O)c2cnc(C)cn2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109033
PNG
(CHEMBL3600448)
Show SMILES CCCc1nc(C[C@H](NC(=O)c2nccnc2N)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
Show InChI InChI=1S/C19H26N8O3/c1-2-4-14-24-10-11(25-14)9-12(19(30)27-8-3-5-13(27)17(21)28)26-18(29)15-16(20)23-7-6-22-15/h6-7,10,12-13H,2-5,8-9H2,1H3,(H2,20,23)(H2,21,28)(H,24,25)(H,26,29)/t12-,13-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109034
PNG
(CHEMBL3600449)
Show SMILES CCCc1nc(C[C@H](NC(=O)[C@H]2CCCCN2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
Show InChI InChI=1S/C20H32N6O3/c1-2-6-17-23-12-13(24-17)11-15(25-19(28)14-7-3-4-9-22-14)20(29)26-10-5-8-16(26)18(21)27/h12,14-16,22H,2-11H2,1H3,(H2,21,27)(H,23,24)(H,25,28)/t14-,15+,16+/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109039
PNG
(CHEMBL3600454)
Show SMILES Cc1cnc(cn1)C(=O)N[C@@H](Cc1nc(Br)[nH]c1Br)C(=O)N1CCC[C@H]1C(N)=O |r|
Show InChI InChI=1S/C17H19Br2N7O3/c1-8-6-22-11(7-21-8)15(28)23-10(5-9-13(18)25-17(19)24-9)16(29)26-4-2-3-12(26)14(20)27/h6-7,10,12H,2-5H2,1H3,(H2,20,27)(H,23,28)(H,24,25)/t10-,12-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R2 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109034
PNG
(CHEMBL3600449)
Show SMILES CCCc1nc(C[C@H](NC(=O)[C@H]2CCCCN2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
Show InChI InChI=1S/C20H32N6O3/c1-2-6-17-23-12-13(24-17)11-15(25-19(28)14-7-3-4-9-22-14)20(29)26-10-5-8-16(26)18(21)27/h12,14-16,22H,2-11H2,1H3,(H2,21,27)(H,23,24)(H,25,28)/t14-,15+,16+/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109026
PNG
(CHEMBL3600445)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(I)n(Cc2ccccc2)c1I)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C23H23I2N7O3/c24-19-15(30-23(25)32(19)13-14-5-2-1-3-6-14)11-16(29-21(34)17-12-27-8-9-28-17)22(35)31-10-4-7-18(31)20(26)33/h1-3,5-6,8-9,12,16,18H,4,7,10-11,13H2,(H2,26,33)(H,29,34)/t16-,18-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109023
PNG
(CHEMBL3601786)
Show SMILES CCn1c(I)nc(C[C@H](NC(=O)c2cnccn2)C(=O)N2CCC[C@H]2C(N)=O)c1I |r|
Show InChI InChI=1S/C18H21I2N7O3/c1-2-26-14(19)10(25-18(26)20)8-11(24-16(29)12-9-22-5-6-23-12)17(30)27-7-3-4-13(27)15(21)28/h5-6,9,11,13H,2-4,7-8H2,1H3,(H2,21,28)(H,24,29)/t11-,13-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109022
PNG
(CHEMBL3601785)
Show SMILES Cn1cnc(C[C@H](NC(=O)c2cnccn2)C(=O)N2CCC[C@H]2C(N)=O)c1Br |r|
Show InChI InChI=1S/C17H20BrN7O3/c1-24-9-22-10(14(24)18)7-11(23-16(27)12-8-20-4-5-21-12)17(28)25-6-2-3-13(25)15(19)26/h4-5,8-9,11,13H,2-3,6-7H2,1H3,(H2,19,26)(H,23,27)/t11-,13-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109037
PNG
(CHEMBL3600452)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc[nH]c1Br)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C16H18BrN7O3/c17-13-9(21-8-22-13)6-10(23-15(26)11-7-19-3-4-20-11)16(27)24-5-1-2-12(24)14(18)25/h3-4,7-8,10,12H,1-2,5-6H2,(H2,18,25)(H,21,22)(H,23,26)/t10-,12-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109036
PNG
(CHEMBL3600451)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc[nH]c1Cl)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C16H18ClN7O3/c17-13-9(21-8-22-13)6-10(23-15(26)11-7-19-3-4-20-11)16(27)24-5-1-2-12(24)14(18)25/h3-4,7-8,10,12H,1-2,5-6H2,(H2,18,25)(H,21,22)(H,23,26)/t10-,12-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109041
PNG
(CHEMBL3601781)
Show SMILES Cc1cnc(cn1)C(=O)N[C@@H](Cc1nc[nH]c1Br)C(=O)N1CCC[C@H]1C(N)=O |r|
Show InChI InChI=1S/C17H20BrN7O3/c1-9-6-21-12(7-20-9)16(27)24-11(5-10-14(18)23-8-22-10)17(28)25-4-2-3-13(25)15(19)26/h6-8,11,13H,2-5H2,1H3,(H2,19,26)(H,22,23)(H,24,27)/t11-,13-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109038
PNG
(CHEMBL3600453)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(Br)[nH]c1Br)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C16H17Br2N7O3/c17-12-8(23-16(18)24-12)6-9(22-14(27)10-7-20-3-4-21-10)15(28)25-5-1-2-11(25)13(19)26/h3-4,7,9,11H,1-2,5-6H2,(H2,19,26)(H,22,27)(H,23,24)/t9-,11-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109018
PNG
(CHEMBL3601784)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(I)[nH]c1I)NC(=O)c1cnccn1 |r|
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109017
PNG
(CHEMBL3601783)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(Br)[nH]c1Br)NC(=O)c1nccnc1N |r|
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109040
PNG
(CHEMBL3601782)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc[nH]c1Br)NC(=O)c1nccnc1N |r|
Show InChI InChI=1S/C16H19BrN8O3/c17-12-8(22-7-23-12)6-9(16(28)25-5-1-2-10(25)14(19)26)24-15(27)11-13(18)21-4-3-20-11/h3-4,7,9-10H,1-2,5-6H2,(H2,18,21)(H2,19,26)(H,22,23)(H,24,27)/t9-,10-/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-1-MeHis-TRH from mouse TRH-R1 expressed in HEK293 cells incubated up to 4 hrs by scintillation counting method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109017
PNG
(CHEMBL3601783)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(Br)[nH]c1Br)NC(=O)c1nccnc1N |r|
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n/an/an/an/a 290n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50072394
PNG
(1-[3-(1H-4-imidazolyl)-2-(5-oxotetrahydro-1H-2-pyr...)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1 |r|
Show InChI InChI=1S/C16H22N6O4/c17-14(24)12-2-1-5-22(12)16(26)11(6-9-7-18-8-19-9)21-15(25)10-3-4-13(23)20-10/h7-8,10-12H,1-6H2,(H2,17,24)(H,18,19)(H,20,23)(H,21,25)/t10-,11-,12-/m0/s1
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n/an/an/an/a 1n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109035
PNG
(CHEMBL3600450)
Show SMILES CC(C)c1nc(C[C@H](NC(=O)[C@H]2CCCCN2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
Show InChI InChI=1S/C20H32N6O3/c1-12(2)18-23-11-13(24-18)10-15(25-19(28)14-6-3-4-8-22-14)20(29)26-9-5-7-16(26)17(21)27/h11-12,14-16,22H,3-10H2,1-2H3,(H2,21,27)(H,23,24)(H,25,28)/t14-,15+,16+/m1/s1
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n/an/an/an/a 1.00E+3n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109039
PNG
(CHEMBL3600454)
Show SMILES Cc1cnc(cn1)C(=O)N[C@@H](Cc1nc(Br)[nH]c1Br)C(=O)N1CCC[C@H]1C(N)=O |r|
Show InChI InChI=1S/C17H19Br2N7O3/c1-8-6-22-11(7-21-8)15(28)23-10(5-9-13(18)25-17(19)24-9)16(29)26-4-2-3-12(26)14(20)27/h6-7,10,12H,2-5H2,1H3,(H2,20,27)(H,23,28)(H,24,25)/t10-,12-/m0/s1
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n/an/an/an/a 100n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109018
PNG
(CHEMBL3601784)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(I)[nH]c1I)NC(=O)c1cnccn1 |r|
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n/an/an/an/a 310n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109034
PNG
(CHEMBL3600449)
Show SMILES CCCc1nc(C[C@H](NC(=O)[C@H]2CCCCN2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
Show InChI InChI=1S/C20H32N6O3/c1-2-6-17-23-12-13(24-17)11-15(25-19(28)14-7-3-4-9-22-14)20(29)26-10-5-8-16(26)18(21)27/h12,14-16,22H,2-11H2,1H3,(H2,21,27)(H,23,24)(H,25,28)/t14-,15+,16+/m1/s1
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n/an/an/an/a 4n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50072394
PNG
(1-[3-(1H-4-imidazolyl)-2-(5-oxotetrahydro-1H-2-pyr...)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1 |r|
Show InChI InChI=1S/C16H22N6O4/c17-14(24)12-2-1-5-22(12)16(26)11(6-9-7-18-8-19-9)21-15(25)10-3-4-13(23)20-10/h7-8,10-12H,1-6H2,(H2,17,24)(H,18,19)(H,20,23)(H,21,25)/t10-,11-,12-/m0/s1
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n/an/an/an/a 0.520n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109018
PNG
(CHEMBL3601784)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(I)[nH]c1I)NC(=O)c1cnccn1 |r|
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n/an/an/an/a 1.13E+4n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109036
PNG
(CHEMBL3600451)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc[nH]c1Cl)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C16H18ClN7O3/c17-13-9(21-8-22-13)6-10(23-15(26)11-7-19-3-4-20-11)16(27)24-5-1-2-12(24)14(18)25/h3-4,7-8,10,12H,1-2,5-6H2,(H2,18,25)(H,21,22)(H,23,26)/t10-,12-/m0/s1
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n/an/an/an/a 530n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109025
PNG
(CHEMBL3600444)
Show SMILES Cc1cnc(cn1)C(=O)N[C@@H](Cc1nc(I)n(Cc2ccccc2)c1I)C(=O)N1CCC[C@H]1C(N)=O |r|
Show InChI InChI=1S/C24H25I2N7O3/c1-14-11-29-18(12-28-14)22(35)30-17(23(36)32-9-5-8-19(32)21(27)34)10-16-20(25)33(24(26)31-16)13-15-6-3-2-4-7-15/h2-4,6-7,11-12,17,19H,5,8-10,13H2,1H3,(H2,27,34)(H,30,35)/t17-,19-/m0/s1
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n/an/an/an/a 50n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109038
PNG
(CHEMBL3600453)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(Br)[nH]c1Br)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C16H17Br2N7O3/c17-12-8(23-16(18)24-12)6-9(22-14(27)10-7-20-3-4-21-10)15(28)25-5-1-2-11(25)13(19)26/h3-4,7,9,11H,1-2,5-6H2,(H2,19,26)(H,22,27)(H,23,24)/t9-,11-/m0/s1
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n/an/an/an/a 2.54E+3n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109017
PNG
(CHEMBL3601783)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(Br)[nH]c1Br)NC(=O)c1nccnc1N |r|
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n/an/an/an/a 1.41E+3n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109023
PNG
(CHEMBL3601786)
Show SMILES CCn1c(I)nc(C[C@H](NC(=O)c2cnccn2)C(=O)N2CCC[C@H]2C(N)=O)c1I |r|
Show InChI InChI=1S/C18H21I2N7O3/c1-2-26-14(19)10(25-18(26)20)8-11(24-16(29)12-9-22-5-6-23-12)17(30)27-7-3-4-13(27)15(21)28/h5-6,9,11,13H,2-4,7-8H2,1H3,(H2,21,28)(H,24,29)/t11-,13-/m0/s1
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n/an/an/an/a 7.21E+3n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109022
PNG
(CHEMBL3601785)
Show SMILES Cn1cnc(C[C@H](NC(=O)c2cnccn2)C(=O)N2CCC[C@H]2C(N)=O)c1Br |r|
Show InChI InChI=1S/C17H20BrN7O3/c1-24-9-22-10(14(24)18)7-11(23-16(27)12-8-20-4-5-21-12)17(28)25-6-2-3-13(25)15(19)26/h4-5,8-9,11,13H,2-3,6-7H2,1H3,(H2,19,26)(H,23,27)/t11-,13-/m0/s1
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n/an/an/an/a 30n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109025
PNG
(CHEMBL3600444)
Show SMILES Cc1cnc(cn1)C(=O)N[C@@H](Cc1nc(I)n(Cc2ccccc2)c1I)C(=O)N1CCC[C@H]1C(N)=O |r|
Show InChI InChI=1S/C24H25I2N7O3/c1-14-11-29-18(12-28-14)22(35)30-17(23(36)32-9-5-8-19(32)21(27)34)10-16-20(25)33(24(26)31-16)13-15-6-3-2-4-7-15/h2-4,6-7,11-12,17,19H,5,8-10,13H2,1H3,(H2,27,34)(H,30,35)/t17-,19-/m0/s1
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n/an/an/an/a 740n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109027
PNG
(CHEMBL3600446)
Show SMILES CCCc1nc(C[C@H](NC(=O)c2cnccn2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
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n/an/an/an/a 150n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109034
PNG
(CHEMBL3600449)
Show SMILES CCCc1nc(C[C@H](NC(=O)[C@H]2CCCCN2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
Show InChI InChI=1S/C20H32N6O3/c1-2-6-17-23-12-13(24-17)11-15(25-19(28)14-7-3-4-9-22-14)20(29)26-10-5-8-16(26)18(21)27/h12,14-16,22H,2-11H2,1H3,(H2,21,27)(H,23,24)(H,25,28)/t14-,15+,16+/m1/s1
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n/an/an/an/a 940n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109026
PNG
(CHEMBL3600445)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(I)n(Cc2ccccc2)c1I)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C23H23I2N7O3/c24-19-15(30-23(25)32(19)13-14-5-2-1-3-6-14)11-16(29-21(34)17-12-27-8-9-28-17)22(35)31-10-4-7-18(31)20(26)33/h1-3,5-6,8-9,12,16,18H,4,7,10-11,13H2,(H2,26,33)(H,29,34)/t16-,18-/m0/s1
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n/an/an/an/a 30n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109033
PNG
(CHEMBL3600448)
Show SMILES CCCc1nc(C[C@H](NC(=O)c2nccnc2N)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
Show InChI InChI=1S/C19H26N8O3/c1-2-4-14-24-10-11(25-14)9-12(19(30)27-8-3-5-13(27)17(21)28)26-18(29)15-16(20)23-7-6-22-15/h6-7,10,12-13H,2-5,8-9H2,1H3,(H2,20,23)(H2,21,28)(H,24,25)(H,26,29)/t12-,13-/m0/s1
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n/an/an/an/a 120n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109039
PNG
(CHEMBL3600454)
Show SMILES Cc1cnc(cn1)C(=O)N[C@@H](Cc1nc(Br)[nH]c1Br)C(=O)N1CCC[C@H]1C(N)=O |r|
Show InChI InChI=1S/C17H19Br2N7O3/c1-8-6-22-11(7-21-8)15(28)23-10(5-9-13(18)25-17(19)24-9)16(29)26-4-2-3-12(26)14(20)27/h6-7,10,12H,2-5H2,1H3,(H2,20,27)(H,23,28)(H,24,25)/t10-,12-/m0/s1
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n/an/an/an/a 77n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109022
PNG
(CHEMBL3601785)
Show SMILES Cn1cnc(C[C@H](NC(=O)c2cnccn2)C(=O)N2CCC[C@H]2C(N)=O)c1Br |r|
Show InChI InChI=1S/C17H20BrN7O3/c1-24-9-22-10(14(24)18)7-11(23-16(27)12-8-20-4-5-21-12)17(28)25-6-2-3-13(25)15(19)26/h4-5,8-9,11,13H,2-3,6-7H2,1H3,(H2,19,26)(H,23,27)/t11-,13-/m0/s1
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n/an/an/an/a 340n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109026
PNG
(CHEMBL3600445)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(I)n(Cc2ccccc2)c1I)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C23H23I2N7O3/c24-19-15(30-23(25)32(19)13-14-5-2-1-3-6-14)11-16(29-21(34)17-12-27-8-9-28-17)22(35)31-10-4-7-18(31)20(26)33/h1-3,5-6,8-9,12,16,18H,4,7,10-11,13H2,(H2,26,33)(H,29,34)/t16-,18-/m0/s1
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n/an/an/an/a 980n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109028
PNG
(CHEMBL3600447)
Show SMILES CCCc1nc(C[C@H](NC(=O)c2cnc(C)cn2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
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n/an/an/an/a 17n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109037
PNG
(CHEMBL3600452)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc[nH]c1Br)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C16H18BrN7O3/c17-13-9(21-8-22-13)6-10(23-15(26)11-7-19-3-4-20-11)16(27)24-5-1-2-12(24)14(18)25/h3-4,7-8,10,12H,1-2,5-6H2,(H2,18,25)(H,21,22)(H,23,26)/t10-,12-/m0/s1
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n/an/an/an/a 48n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109040
PNG
(CHEMBL3601782)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc[nH]c1Br)NC(=O)c1nccnc1N |r|
Show InChI InChI=1S/C16H19BrN8O3/c17-12-8(22-7-23-12)6-9(16(28)25-5-1-2-10(25)14(19)26)24-15(27)11-13(18)21-4-3-20-11/h3-4,7,9-10H,1-2,5-6H2,(H2,18,21)(H2,19,26)(H,22,23)(H,24,27)/t9-,10-/m0/s1
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n/an/an/an/a 6n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109023
PNG
(CHEMBL3601786)
Show SMILES CCn1c(I)nc(C[C@H](NC(=O)c2cnccn2)C(=O)N2CCC[C@H]2C(N)=O)c1I |r|
Show InChI InChI=1S/C18H21I2N7O3/c1-2-26-14(19)10(25-18(26)20)8-11(24-16(29)12-9-22-5-6-23-12)17(30)27-7-3-4-13(27)15(21)28/h5-6,9,11,13H,2-4,7-8H2,1H3,(H2,21,28)(H,24,29)/t11-,13-/m0/s1
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n/an/an/an/a 960n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109037
PNG
(CHEMBL3600452)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc[nH]c1Br)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C16H18BrN7O3/c17-13-9(21-8-22-13)6-10(23-15(26)11-7-19-3-4-20-11)16(27)24-5-1-2-12(24)14(18)25/h3-4,7-8,10,12H,1-2,5-6H2,(H2,18,25)(H,21,22)(H,23,26)/t10-,12-/m0/s1
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n/an/an/an/a 3.98E+3n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109041
PNG
(CHEMBL3601781)
Show SMILES Cc1cnc(cn1)C(=O)N[C@@H](Cc1nc[nH]c1Br)C(=O)N1CCC[C@H]1C(N)=O |r|
Show InChI InChI=1S/C17H20BrN7O3/c1-9-6-21-12(7-20-9)16(27)24-11(5-10-14(18)23-8-22-10)17(28)25-4-2-3-13(25)15(19)26/h6-8,11,13H,2-5H2,1H3,(H2,19,26)(H,22,23)(H,24,27)/t11-,13-/m0/s1
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n/an/an/an/a 498n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109038
PNG
(CHEMBL3600453)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc(Br)[nH]c1Br)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C16H17Br2N7O3/c17-12-8(23-16(18)24-12)6-9(22-14(27)10-7-20-3-4-21-10)15(28)25-5-1-2-11(25)13(19)26/h3-4,7,9,11H,1-2,5-6H2,(H2,19,26)(H,22,27)(H,23,24)/t9-,11-/m0/s1
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n/an/an/an/a 50n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109041
PNG
(CHEMBL3601781)
Show SMILES Cc1cnc(cn1)C(=O)N[C@@H](Cc1nc[nH]c1Br)C(=O)N1CCC[C@H]1C(N)=O |r|
Show InChI InChI=1S/C17H20BrN7O3/c1-9-6-21-12(7-20-9)16(27)24-11(5-10-14(18)23-8-22-10)17(28)25-4-2-3-13(25)15(19)26/h6-8,11,13H,2-5H2,1H3,(H2,19,26)(H,22,23)(H,24,27)/t11-,13-/m0/s1
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n/an/an/an/a 40n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109027
PNG
(CHEMBL3600446)
Show SMILES CCCc1nc(C[C@H](NC(=O)c2cnccn2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
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n/an/an/an/a 60n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109028
PNG
(CHEMBL3600447)
Show SMILES CCCc1nc(C[C@H](NC(=O)c2cnc(C)cn2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
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n/an/an/an/a 15n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(Mus musculus)		BDBM50109035
PNG
(CHEMBL3600450)
Show SMILES CC(C)c1nc(C[C@H](NC(=O)[C@H]2CCCCN2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
Show InChI InChI=1S/C20H32N6O3/c1-12(2)18-23-11-13(24-18)10-15(25-19(28)14-6-3-4-8-22-14)20(29)26-9-5-7-16(26)17(21)27/h11-12,14-16,22H,3-10H2,1-2H3,(H2,21,27)(H,23,24)(H,25,28)/t14-,15+,16+/m1/s1
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n/an/an/an/a 770n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R2 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109040
PNG
(CHEMBL3601782)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc[nH]c1Br)NC(=O)c1nccnc1N |r|
Show InChI InChI=1S/C16H19BrN8O3/c17-12-8(22-7-23-12)6-9(16(28)25-5-1-2-10(25)14(19)26)24-15(27)11-13(18)21-4-3-20-11/h3-4,7,9-10H,1-2,5-6H2,(H2,18,21)(H2,19,26)(H,22,23)(H,24,27)/t9-,10-/m0/s1
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n/an/an/an/a 287n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109033
PNG
(CHEMBL3600448)
Show SMILES CCCc1nc(C[C@H](NC(=O)c2nccnc2N)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |r|
Show InChI InChI=1S/C19H26N8O3/c1-2-4-14-24-10-11(25-14)9-12(19(30)27-8-3-5-13(27)17(21)28)26-18(29)15-16(20)23-7-6-22-15/h6-7,10,12-13H,2-5,8-9H2,1H3,(H2,20,23)(H2,21,28)(H,24,25)(H,26,29)/t12-,13-/m0/s1
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n/an/an/an/a 1.56E+3n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
Thyrotropin-releasing hormone receptor


(MOUSE)		BDBM50109036
PNG
(CHEMBL3600451)
Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc[nH]c1Cl)NC(=O)c1cnccn1 |r|
Show InChI InChI=1S/C16H18ClN7O3/c17-13-9(21-8-22-13)6-10(23-15(26)11-7-19-3-4-20-11)16(27)24-5-1-2-12(24)14(18)25/h3-4,7-8,10,12H,1-2,5-6H2,(H2,18,25)(H,21,22)(H,23,26)/t10-,12-/m0/s1
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n/an/an/an/a 1.94E+4n/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Agonist activity at mouse TRH-R1 expressed in HEK293 cells assessed as induction of changes in intracellular Ca2+ level by FLIPR method

Bioorg Med Chem 23: 5641-53 (2015)


Article DOI: 10.1016/j.bmc.2015.07.022
BindingDB Entry DOI: 10.7270/Q2JH3NZ9
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%