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Compile Data Set for Download or QSAR

Found 6 hits of kd data for polymerid = 49001069,49001070   
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
Urotensin-2 receptor


(Homo sapiens (Human))
BDBM50412075
PNG
(CHEMBL404177)
Show SMILES Clc1ccc2scc(CC(=O)N3CCC[C@@H]([C@@H]3CN3CCCC3)c3ccccc3)c2c1
Show InChI InChI=1S/C26H29ClN2OS/c27-21-10-11-25-23(16-21)20(18-31-25)15-26(30)29-14-6-9-22(19-7-2-1-3-8-19)24(29)17-28-12-4-5-13-28/h1-3,7-8,10-11,16,18,22,24H,4-6,9,12-15,17H2/t22-,24+/m1/s1
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n/an/an/a 10n/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human urotensin 2 receptor


Bioorg Med Chem Lett 18: 2860-4 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.078
BindingDB Entry DOI: 10.7270/Q29S1RXX
More data for this
Ligand-Target Pair
Urotensin-2 receptor


(Homo sapiens (Human))
BDBM50413017
PNG
(CHEMBL500880)
Show SMILES C(Nc1nccc2[nH]c3ccccc3c12)c1ccccc1
Show InChI InChI=1S/C18H15N3/c1-2-6-13(7-3-1)12-20-18-17-14-8-4-5-9-15(14)21-16(17)10-11-19-18/h1-11,21H,12H2,(H,19,20)
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n/an/an/a 19.9n/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human urotensin 2 receptor by FLIPR assay


Bioorg Med Chem Lett 18: 4936-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.054
BindingDB Entry DOI: 10.7270/Q2GH9K5T
More data for this
Ligand-Target Pair
Urotensin-2 receptor


(Homo sapiens (Human))
BDBM50413014
PNG
(CHEMBL497171)
Show SMILES CCCCNc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C15H17N3/c1-2-3-9-16-15-14-11-6-4-5-7-12(11)18-13(14)8-10-17-15/h4-8,10,18H,2-3,9H2,1H3,(H,16,17)
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n/an/an/a 100n/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human urotensin 2 receptor by FLIPR assay


Bioorg Med Chem Lett 18: 4936-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.054
BindingDB Entry DOI: 10.7270/Q2GH9K5T
More data for this
Ligand-Target Pair
Urotensin-2 receptor


(Homo sapiens (Human))
BDBM50413020
PNG
(CHEMBL523566)
Show SMILES CCC(C)CNc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C16H19N3/c1-3-11(2)10-18-16-15-12-6-4-5-7-13(12)19-14(15)8-9-17-16/h4-9,11,19H,3,10H2,1-2H3,(H,17,18)
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n/an/an/a 100n/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human urotensin 2 receptor by FLIPR assay


Bioorg Med Chem Lett 18: 4936-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.054
BindingDB Entry DOI: 10.7270/Q2GH9K5T
More data for this
Ligand-Target Pair
Urotensin-2 receptor


(Homo sapiens (Human))
BDBM50413018
PNG
(CHEMBL497561)
Show SMILES C(Nc1nccc2[nH]c3ccccc3c12)C1CC1
Show InChI InChI=1S/C15H15N3/c1-2-4-12-11(3-1)14-13(18-12)7-8-16-15(14)17-9-10-5-6-10/h1-4,7-8,10,18H,5-6,9H2,(H,16,17)
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n/an/an/a 126n/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human urotensin 2 receptor by FLIPR assay


Bioorg Med Chem Lett 18: 4936-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.054
BindingDB Entry DOI: 10.7270/Q2GH9K5T
More data for this
Ligand-Target Pair
Urotensin-2 receptor


(Homo sapiens (Human))
BDBM50413016
PNG
(CHEMBL496516)
Show SMILES C(Nc1nccc2[nH]c3ccccc3c12)c1cccs1
Show InChI InChI=1S/C16H13N3S/c1-2-6-13-12(5-1)15-14(19-13)7-8-17-16(15)18-10-11-4-3-9-20-11/h1-9,19H,10H2,(H,17,18)
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PC cid
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n/an/an/a 158n/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human urotensin 2 receptor by FLIPR assay


Bioorg Med Chem Lett 18: 4936-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.054
BindingDB Entry DOI: 10.7270/Q2GH9K5T
More data for this
Ligand-Target Pair