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Compile Data Set for Download or QSAR

Found 35 hits Enz. Inhib. hit(s) with all data for entry = 50041749   
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
Urotensin-2


(Homo sapiens (Human))
BDBM50414757
PNG
(CHEMBL572454)
Show SMILES CO[C@@H](C(=O)N[C@@H](CCN(C)C)c1ccc2ccccc2c1)c1ccccc1 |r|
Show InChI InChI=1S/C24H28N2O2/c1-26(2)16-15-22(21-14-13-18-9-7-8-12-20(18)17-21)25-24(27)23(28-3)19-10-5-4-6-11-19/h4-14,17,22-23H,15-16H2,1-3H3,(H,25,27)/t22-,23+/m0/s1
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n/an/an/an/a 741n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414791
PNG
(CHEMBL576922)
Show SMILES Clc1ccc(cc1)C(CCN1CCCCC1)NC(=O)c1ccccc1
Show InChI InChI=1S/C21H25ClN2O/c22-19-11-9-17(10-12-19)20(13-16-24-14-5-2-6-15-24)23-21(25)18-7-3-1-4-8-18/h1,3-4,7-12,20H,2,5-6,13-16H2,(H,23,25)
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n/an/an/an/a 6.46E+3n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414759
PNG
(CHEMBL574304)
Show SMILES CO[C@@H](C(=O)N[C@@H](CCN(C)C)c1ccc(Cl)cc1)c1ccccc1 |r|
Show InChI InChI=1S/C20H25ClN2O2/c1-23(2)14-13-18(15-9-11-17(21)12-10-15)22-20(24)19(25-3)16-7-5-4-6-8-16/h4-12,18-19H,13-14H2,1-3H3,(H,22,24)/t18-,19+/m0/s1
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n/an/an/an/a 871n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414760
PNG
(CHEMBL573837)
Show SMILES CO[C@@H](C(=O)N[C@H](CCN(C)C)c1ccc(Cl)cc1)c1ccccc1 |r|
Show InChI InChI=1S/C20H25ClN2O2/c1-23(2)14-13-18(15-9-11-17(21)12-10-15)22-20(24)19(25-3)16-7-5-4-6-8-16/h4-12,18-19H,13-14H2,1-3H3,(H,22,24)/t18-,19-/m1/s1
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n/an/an/an/a 5.01E+3n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414761
PNG
(CHEMBL573836)
Show SMILES CN(C)CCCC(NC(=O)c1ccccc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C19H23ClN2O/c1-22(2)14-6-9-18(15-10-12-17(20)13-11-15)21-19(23)16-7-4-3-5-8-16/h3-5,7-8,10-13,18H,6,9,14H2,1-2H3,(H,21,23)
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n/an/an/an/a 3.80E+3n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414762
PNG
(CHEMBL576746)
Show SMILES CN(C)CCCC(NC(=O)c1ccc(cc1)-c1ccccc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C25H27ClN2O/c1-28(2)18-6-9-24(21-14-16-23(26)17-15-21)27-25(29)22-12-10-20(11-13-22)19-7-4-3-5-8-19/h3-5,7-8,10-17,24H,6,9,18H2,1-2H3,(H,27,29)
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n/an/an/an/a 316n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414763
PNG
(CHEMBL572467)
Show SMILES Clc1ccc(cc1)C(CCN1CCCCC1)NC(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C27H29ClN2O/c28-25-15-13-23(14-16-25)26(17-20-30-18-5-2-6-19-30)29-27(31)24-11-9-22(10-12-24)21-7-3-1-4-8-21/h1,3-4,7-16,26H,2,5-6,17-20H2,(H,29,31)
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n/an/an/an/a 661n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414764
PNG
(CHEMBL578853)
Show SMILES CN(C)CCC(NC(=O)c1ccc(cc1)-c1ccc2ccccc2c1)c1ccc2ccccc2c1
Show InChI InChI=1S/C32H30N2O/c1-34(2)20-19-31(30-18-14-24-8-4-6-10-28(24)22-30)33-32(35)26-15-11-25(12-16-26)29-17-13-23-7-3-5-9-27(23)21-29/h3-18,21-22,31H,19-20H2,1-2H3,(H,33,35)
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n/an/an/an/a 525n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414765
PNG
(CHEMBL578654)
Show SMILES COc1ccc(cc1)-c1ccc(cc1)C(=O)NC(CCN(C)C)c1ccc2ccccc2c1
Show InChI InChI=1S/C29H30N2O2/c1-31(2)19-18-28(26-13-10-21-6-4-5-7-25(21)20-26)30-29(32)24-11-8-22(9-12-24)23-14-16-27(33-3)17-15-23/h4-17,20,28H,18-19H2,1-3H3,(H,30,32)
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n/an/an/an/a 105n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414766
PNG
(CHEMBL572439)
Show SMILES CN(C)CCC(NC(=O)c1ccc(cc1)-c1ccc(Cl)cc1)c1ccc2ccccc2c1
Show InChI InChI=1S/C28H27ClN2O/c1-31(2)18-17-27(25-12-9-20-5-3-4-6-24(20)19-25)30-28(32)23-10-7-21(8-11-23)22-13-15-26(29)16-14-22/h3-16,19,27H,17-18H2,1-2H3,(H,30,32)
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n/an/an/an/a 43.6n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414767
PNG
(CHEMBL574527)
Show SMILES CN(C)CCC(NC(=O)c1ccc(cc1)-c1ccccc1)c1ccc2ccccc2c1
Show InChI InChI=1S/C28H28N2O/c1-30(2)19-18-27(26-17-14-22-10-6-7-11-25(22)20-26)29-28(31)24-15-12-23(13-16-24)21-8-4-3-5-9-21/h3-17,20,27H,18-19H2,1-2H3,(H,29,31)
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n/an/an/an/a 120n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414768
PNG
(CHEMBL572423)
Show SMILES CN(C)CCC(NC(=O)c1cccc(c1)-c1ccc2ccccc2c1)c1ccc2ccccc2c1
Show InChI InChI=1S/C32H30N2O/c1-34(2)19-18-31(29-17-15-24-9-4-6-11-26(24)21-29)33-32(35)30-13-7-12-27(22-30)28-16-14-23-8-3-5-10-25(23)20-28/h3-17,20-22,31H,18-19H2,1-2H3,(H,33,35)
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n/an/an/an/a 3.47E+3n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414769
PNG
(CHEMBL573574)
Show SMILES COc1ccc(cc1)-c1cccc(c1)C(=O)NC(CCN(C)C)c1ccc2ccccc2c1
Show InChI InChI=1S/C29H30N2O2/c1-31(2)18-17-28(25-12-11-21-7-4-5-8-23(21)19-25)30-29(32)26-10-6-9-24(20-26)22-13-15-27(33-3)16-14-22/h4-16,19-20,28H,17-18H2,1-3H3,(H,30,32)
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n/an/an/an/a 646n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414770
PNG
(CHEMBL574726)
Show SMILES CN(C)CCC(NC(=O)c1cccc(c1)-c1ccc(Cl)cc1)c1ccc2ccccc2c1
Show InChI InChI=1S/C28H27ClN2O/c1-31(2)17-16-27(24-11-10-20-6-3-4-7-22(20)18-24)30-28(32)25-9-5-8-23(19-25)21-12-14-26(29)15-13-21/h3-15,18-19,27H,16-17H2,1-2H3,(H,30,32)
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n/an/an/an/a 1.10E+3n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414771
PNG
(CHEMBL575819)
Show SMILES CN(C)CCC(NC(=O)c1cccc(c1)-c1ccccc1)c1ccc2ccccc2c1
Show InChI InChI=1S/C28H28N2O/c1-30(2)18-17-27(25-16-15-22-11-6-7-12-23(22)19-25)29-28(31)26-14-8-13-24(20-26)21-9-4-3-5-10-21/h3-16,19-20,27H,17-18H2,1-2H3,(H,29,31)
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n/an/an/an/a 537n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414772
PNG
(CHEMBL575630)
Show SMILES CN(C)CCC(NC(=O)c1ccc(cc1)-c1ccc2ccccc2c1)c1ccc(C)cc1
Show InChI InChI=1S/C29H30N2O/c1-21-8-10-24(11-9-21)28(18-19-31(2)3)30-29(32)25-15-12-23(13-16-25)27-17-14-22-6-4-5-7-26(22)20-27/h4-17,20,28H,18-19H2,1-3H3,(H,30,32)
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n/an/an/an/a 813n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414773
PNG
(CHEMBL575629)
Show SMILES COc1ccc(cc1)-c1ccc(cc1)C(=O)NC(CCN(C)C)c1ccc(C)cc1
Show InChI InChI=1S/C26H30N2O2/c1-19-5-7-22(8-6-19)25(17-18-28(2)3)27-26(29)23-11-9-20(10-12-23)21-13-15-24(30-4)16-14-21/h5-16,25H,17-18H2,1-4H3,(H,27,29)
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n/an/an/an/a 347n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414774
PNG
(CHEMBL572883)
Show SMILES CN(C)CCC(NC(=O)c1ccc(cc1)-c1ccc(Cl)cc1)c1ccc(C)cc1
Show InChI InChI=1S/C25H27ClN2O/c1-18-4-6-21(7-5-18)24(16-17-28(2)3)27-25(29)22-10-8-19(9-11-22)20-12-14-23(26)15-13-20/h4-15,24H,16-17H2,1-3H3,(H,27,29)
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n/an/an/an/a 126n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414775
PNG
(CHEMBL572398)
Show SMILES CN(C)CCC(NC(=O)c1ccc(cc1)-c1ccccc1)c1ccc(C)cc1
Show InChI InChI=1S/C25H28N2O/c1-19-9-11-22(12-10-19)24(17-18-27(2)3)26-25(28)23-15-13-21(14-16-23)20-7-5-4-6-8-20/h4-16,24H,17-18H2,1-3H3,(H,26,28)
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n/an/an/an/a 200n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414776
PNG
(CHEMBL574732)
Show SMILES COc1ccc(cc1)-c1cccc(c1)C(=O)NC(CCN(C)C)c1ccc(C)cc1
Show InChI InChI=1S/C26H30N2O2/c1-19-8-10-21(11-9-19)25(16-17-28(2)3)27-26(29)23-7-5-6-22(18-23)20-12-14-24(30-4)15-13-20/h5-15,18,25H,16-17H2,1-4H3,(H,27,29)
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n/an/an/an/a 1.07E+3n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414777
PNG
(CHEMBL574731)
Show SMILES CN(C)CCC(NC(=O)c1cccc(c1)-c1ccc(Cl)cc1)c1ccc(C)cc1
Show InChI InChI=1S/C25H27ClN2O/c1-18-7-9-20(10-8-18)24(15-16-28(2)3)27-25(29)22-6-4-5-21(17-22)19-11-13-23(26)14-12-19/h4-14,17,24H,15-16H2,1-3H3,(H,27,29)
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n/an/an/an/a 646n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414778
PNG
(CHEMBL572392)
Show SMILES CN(C)CCC(NC(=O)c1cccc(c1)-c1ccccc1)c1ccc(C)cc1
Show InChI InChI=1S/C25H28N2O/c1-19-12-14-21(15-13-19)24(16-17-27(2)3)26-25(28)23-11-7-10-22(18-23)20-8-5-4-6-9-20/h4-15,18,24H,16-17H2,1-3H3,(H,26,28)
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n/an/an/an/a 813n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414779
PNG
(CHEMBL572391)
Show SMILES CN(C)CCC(NC(=O)c1ccc(cc1)-c1ccc2ccccc2c1)c1ccc(Cl)cc1
Show InChI InChI=1S/C28H27ClN2O/c1-31(2)18-17-27(22-13-15-26(29)16-14-22)30-28(32)23-10-7-21(8-11-23)25-12-9-20-5-3-4-6-24(20)19-25/h3-16,19,27H,17-18H2,1-2H3,(H,30,32)
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n/an/an/an/a 309n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414780
PNG
(CHEMBL573569)
Show SMILES COc1ccc(cc1)-c1ccc(cc1)C(=O)NC(CCN(C)C)c1ccc(Cl)cc1
Show InChI InChI=1S/C25H27ClN2O2/c1-28(2)17-16-24(20-8-12-22(26)13-9-20)27-25(29)21-6-4-18(5-7-21)19-10-14-23(30-3)15-11-19/h4-15,24H,16-17H2,1-3H3,(H,27,29)
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n/an/an/an/a 74.1n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414781
PNG
(CHEMBL572882)
Show SMILES CN(C)CCC(NC(=O)c1ccc(cc1)-c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C24H24Cl2N2O/c1-28(2)16-15-23(19-9-13-22(26)14-10-19)27-24(29)20-5-3-17(4-6-20)18-7-11-21(25)12-8-18/h3-14,23H,15-16H2,1-2H3,(H,27,29)
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n/an/an/an/a 75.9n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414782
PNG
(CHEMBL583981)
Show SMILES CN(C)CCC(NC(=O)c1ccc(cc1)-c1ccccc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C24H25ClN2O/c1-27(2)17-16-23(20-12-14-22(25)15-13-20)26-24(28)21-10-8-19(9-11-21)18-6-4-3-5-7-18/h3-15,23H,16-17H2,1-2H3,(H,26,28)
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n/an/an/an/a 77.6n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414783
PNG
(CHEMBL573575)
Show SMILES CN(C)CCC(NC(=O)c1cccc(c1)-c1ccc2ccccc2c1)c1ccc(Cl)cc1
Show InChI InChI=1S/C28H27ClN2O/c1-31(2)17-16-27(21-12-14-26(29)15-13-21)30-28(32)25-9-5-8-23(19-25)24-11-10-20-6-3-4-7-22(20)18-24/h3-15,18-19,27H,16-17H2,1-2H3,(H,30,32)
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n/an/an/an/a 363n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414784
PNG
(CHEMBL574730)
Show SMILES COc1ccc(cc1)-c1cccc(c1)C(=O)NC(CCN(C)C)c1ccc(Cl)cc1
Show InChI InChI=1S/C25H27ClN2O2/c1-28(2)16-15-24(19-7-11-22(26)12-8-19)27-25(29)21-6-4-5-20(17-21)18-9-13-23(30-3)14-10-18/h4-14,17,24H,15-16H2,1-3H3,(H,27,29)
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n/an/an/an/a 575n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414785
PNG
(CHEMBL582835)
Show SMILES CN(C)CCC(NC(=O)c1cccc(c1)-c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C24H24Cl2N2O/c1-28(2)15-14-23(18-8-12-22(26)13-9-18)27-24(29)20-5-3-4-19(16-20)17-6-10-21(25)11-7-17/h3-13,16,23H,14-15H2,1-2H3,(H,27,29)
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n/an/an/an/a 437n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414786
PNG
(CHEMBL573570)
Show SMILES CN(C)CCC(NC(=O)c1cccc(c1)-c1ccccc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C24H25ClN2O/c1-27(2)16-15-23(19-11-13-22(25)14-12-19)26-24(28)21-10-6-9-20(17-21)18-7-4-3-5-8-18/h3-14,17,23H,15-16H2,1-2H3,(H,26,28)
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n/an/an/an/a 575n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414787
PNG
(CHEMBL573857)
Show SMILES CN(C)CC[C@H](NC(=O)c1ccc(cc1)-c1ccccc1)c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C24H25ClN2O/c1-27(2)17-16-23(20-12-14-22(25)15-13-20)26-24(28)21-10-8-19(9-11-21)18-6-4-3-5-7-18/h3-15,23H,16-17H2,1-2H3,(H,26,28)/t23-/m0/s1
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n/an/an/an/a 32.4n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414788
PNG
(CHEMBL572699)
Show SMILES CN(C)CC[C@@H](NC(=O)c1ccc(cc1)-c1ccccc1)c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C24H25ClN2O/c1-27(2)17-16-23(20-12-14-22(25)15-13-20)26-24(28)21-10-8-19(9-11-21)18-6-4-3-5-7-18/h3-15,23H,16-17H2,1-2H3,(H,26,28)/t23-/m1/s1
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n/an/an/an/a 1.45E+3n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414789
PNG
(CHEMBL573392)
Show SMILES CN(C)CC[C@H](NC(=O)c1ccc(cc1)-c1ccc(Cl)cc1)c1ccc2ccccc2c1 |r|
Show InChI InChI=1S/C28H27ClN2O/c1-31(2)18-17-27(25-12-9-20-5-3-4-6-24(20)19-25)30-28(32)23-10-7-21(8-11-23)22-13-15-26(29)16-14-22/h3-16,19,27H,17-18H2,1-2H3,(H,30,32)/t27-/m0/s1
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n/an/an/an/a 22.9n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414790
PNG
(CHEMBL573640)
Show SMILES CN(C)CC[C@@H](NC(=O)c1ccc(cc1)-c1ccc(Cl)cc1)c1ccc2ccccc2c1 |r|
Show InChI InChI=1S/C28H27ClN2O/c1-31(2)18-17-27(25-12-9-20-5-3-4-6-24(20)19-25)30-28(32)23-10-7-21(8-11-23)22-13-15-26(29)16-14-22/h3-16,19,27H,17-18H2,1-2H3,(H,30,32)/t27-/m1/s1
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n/an/an/an/a 457n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair
Urotensin-2


(Homo sapiens (Human))
BDBM50414758
PNG
(CHEMBL574305)
Show SMILES CO[C@@H](C(=O)N[C@H](CCN(C)C)c1ccc2ccccc2c1)c1ccccc1 |r|
Show InChI InChI=1S/C24H28N2O2/c1-26(2)16-15-22(21-14-13-18-9-7-8-12-20(18)17-21)25-24(27)23(28-3)19-10-5-4-6-11-19/h4-14,17,22-23H,15-16H2,1-3H3,(H,25,27)/t22-,23-/m1/s1
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n/an/an/an/a 2.75E+3n/an/an/an/a



University of Gothenburg

Curated by ChEMBL


Assay Description
Agonist activity against human urotensin 2 receptor expressed in human NIH373 cells assessed as beta-galactosidase activity after 5 days by R-SAT ass...


Bioorg Med Chem 17: 4657-65 (2009)


Article DOI: 10.1016/j.bmc.2009.04.062
BindingDB Entry DOI: 10.7270/Q20866J9
More data for this
Ligand-Target Pair