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Compile Data Set for Download or QSAR

Found 57 hits with Last Name = 'guida' and Initial = 'bf'   
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 receptor


(Homo sapiens (Human))
BDBM50413022
PNG
(CHEMBL497172)
Show SMILES CCCCCNc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C16H19N3/c1-2-3-6-10-17-16-15-12-7-4-5-8-13(12)19-14(15)9-11-18-16/h4-5,7-9,11,19H,2-3,6,10H2,1H3,(H,17,18)
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3.98n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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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3.98n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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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6.31n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413021
PNG
(CHEMBL496920)
Show SMILES CCCCCCNc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C17H21N3/c1-2-3-4-7-11-18-17-16-13-8-5-6-9-14(13)20-15(16)10-12-19-17/h5-6,8-10,12,20H,2-4,7,11H2,1H3,(H,18,19)
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6.31n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413026
PNG
(CHEMBL497562)
Show SMILES C(Nc1nccc2[nH]c3ccccc3c12)C1CCCCC1
Show InChI InChI=1S/C18H21N3/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/h4-5,8-11,13,21H,1-3,6-7,12H2,(H,19,20)
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10n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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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10n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413019
PNG
(CHEMBL495937)
Show SMILES CC(C)CCNc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C16H19N3/c1-11(2)7-9-17-16-15-12-5-3-4-6-13(12)19-14(15)8-10-18-16/h3-6,8,10-11,19H,7,9H2,1-2H3,(H,17,18)
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12.6n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413042
PNG
(CHEMBL495907)
Show SMILES CCOCCNc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C15H17N3O/c1-2-19-10-9-17-15-14-11-5-3-4-6-12(11)18-13(14)7-8-16-15/h3-8,18H,2,9-10H2,1H3,(H,16,17)
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12.6n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
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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12.6n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413027
PNG
(CHEMBL522895)
Show SMILES COCCNc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C14H15N3O/c1-18-9-8-16-14-13-10-4-2-3-5-11(10)17-12(13)6-7-15-14/h2-7,17H,8-9H2,1H3,(H,15,16)
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19.9n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413023
PNG
(CHEMBL509831)
Show SMILES CCCNc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C14H15N3/c1-2-8-15-14-13-10-5-3-4-6-11(10)17-12(13)7-9-16-14/h3-7,9,17H,2,8H2,1H3,(H,15,16)
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25.1n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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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25.1n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413047
PNG
(CHEMBL497580)
Show SMILES CCCCNc1ccnc2[nH]c3c(OC)cccc3c12
Show InChI InChI=1S/C16H19N3O/c1-3-4-9-17-12-8-10-18-16-14(12)11-6-5-7-13(20-2)15(11)19-16/h5-8,10H,3-4,9H2,1-2H3,(H2,17,18,19)
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31.6n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413038
PNG
(CHEMBL497579)
Show SMILES CCCCNc1ccnc2[nH]c3ccc(Cl)cc3c12
Show InChI InChI=1S/C15H16ClN3/c1-2-3-7-17-13-6-8-18-15-14(13)11-9-10(16)4-5-12(11)19-15/h4-6,8-9H,2-3,7H2,1H3,(H2,17,18,19)
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50.1n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413015
PNG
(CHEMBL495918)
Show SMILES CCCCNc1nccc2n(C)c3ccccc3c12
Show InChI InChI=1S/C16H19N3/c1-3-4-10-17-16-15-12-7-5-6-8-13(12)19(2)14(15)9-11-18-16/h5-9,11H,3-4,10H2,1-2H3,(H,17,18)
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50.1n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413037
PNG
(CHEMBL497578)
Show SMILES CCCCNc1ccnc2[nH]c3ccc(C)cc3c12
Show InChI InChI=1S/C16H19N3/c1-3-4-8-17-14-7-9-18-16-15(14)12-10-11(2)5-6-13(12)19-16/h5-7,9-10H,3-4,8H2,1-2H3,(H2,17,18,19)
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63.1n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413033
PNG
(CHEMBL505353)
Show SMILES CCCCNc1nccc2n(C(C)C)c3ccccc3c12
Show InChI InChI=1S/C18H23N3/c1-4-5-11-19-18-17-14-8-6-7-9-15(14)21(13(2)3)16(17)10-12-20-18/h6-10,12-13H,4-5,11H2,1-3H3,(H,19,20)
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63.1n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413045
PNG
(CHEMBL494934)
Show SMILES CCCCNc1ccnc2[nH]c3ccccc3c12
Show InChI InChI=1S/C15H17N3/c1-2-3-9-16-13-8-10-17-15-14(13)11-6-4-5-7-12(11)18-15/h4-8,10H,2-3,9H2,1H3,(H2,16,17,18)
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79.4n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413028
PNG
(CHEMBL525759)
Show SMILES C(Nc1nccc2[nH]c3ccccc3c12)C1CCCO1
Show InChI InChI=1S/C16H17N3O/c1-2-6-13-12(5-1)15-14(19-13)7-8-17-16(15)18-10-11-4-3-9-20-11/h1-2,5-8,11,19H,3-4,9-10H2,(H,17,18)
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79.4n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413041
PNG
(CHEMBL497765)
Show SMILES C(Cc1ccccc1)Nc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C19H17N3/c1-2-6-14(7-3-1)10-12-20-19-18-15-8-4-5-9-16(15)22-17(18)11-13-21-19/h1-9,11,13,22H,10,12H2,(H,20,21)
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100n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413036
PNG
(CHEMBL497368)
Show SMILES C(Nc1ccnc2[nH]c3ccccc3c12)C1CC1
Show InChI InChI=1S/C15H15N3/c1-2-4-12-11(3-1)14-13(17-9-10-5-6-10)7-8-16-15(14)18-12/h1-4,7-8,10H,5-6,9H2,(H2,16,17,18)
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100n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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


(Felis catus)
BDBM50413021
PNG
(CHEMBL496920)
Show SMILES CCCCCCNc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C17H21N3/c1-2-3-4-7-11-18-17-16-13-8-5-6-9-14(13)20-15(16)10-12-19-17/h5-6,8-10,12,20H,2-4,7,11H2,1H3,(H,18,19)
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200n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from cat urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413035
PNG
(CHEMBL495920)
Show SMILES COCCNc1ccnc2[nH]c3ccccc3c12
Show InChI InChI=1S/C14H15N3O/c1-18-9-8-15-12-6-7-16-14-13(12)10-4-2-3-5-11(10)17-14/h2-7H,8-9H2,1H3,(H2,15,16,17)
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316n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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


(Felis catus)
BDBM50413022
PNG
(CHEMBL497172)
Show SMILES CCCCCNc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C16H19N3/c1-2-3-6-10-17-16-15-12-7-4-5-8-13(12)19-14(15)9-11-18-16/h4-5,7-9,11,19H,2-3,6,10H2,1H3,(H,17,18)
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398n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from cat urotensin 2 receptor expressed in HEK293 cells


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


(Felis catus)
BDBM50413015
PNG
(CHEMBL495918)
Show SMILES CCCCNc1nccc2n(C)c3ccccc3c12
Show InChI InChI=1S/C16H19N3/c1-3-4-10-17-16-15-12-7-5-6-8-13(12)19(2)14(15)9-11-18-16/h5-9,11H,3-4,10H2,1-2H3,(H,17,18)
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631n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from cat urotensin 2 receptor expressed in HEK293 cells


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


(Felis catus)
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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631n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from cat urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413048
PNG
(CHEMBL522381)
Show SMILES CCCC(C)Nc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C16H19N3/c1-3-6-11(2)18-16-15-12-7-4-5-8-13(12)19-14(15)9-10-17-16/h4-5,7-11,19H,3,6H2,1-2H3,(H,17,18)
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794n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413046
PNG
(CHEMBL497369)
Show SMILES C(Nc1ccnc2[nH]c3ccccc3c12)C1CCCCC1
Show InChI InChI=1S/C18H21N3/c1-2-6-13(7-3-1)12-20-16-10-11-19-18-17(16)14-8-4-5-9-15(14)21-18/h4-5,8-11,13H,1-3,6-7,12H2,(H2,19,20,21)
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794n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413032
PNG
(CHEMBL522074)
Show SMILES CCCCN(CCCC)c1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C19H25N3/c1-3-5-13-22(14-6-4-2)19-18-15-9-7-8-10-16(15)21-17(18)11-12-20-19/h7-12,21H,3-6,13-14H2,1-2H3
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794n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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


(Felis catus)
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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1.00E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from cat urotensin 2 receptor expressed in HEK293 cells


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


(Felis catus)
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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1.00E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from cat urotensin 2 receptor expressed in HEK293 cells


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


(Felis catus)
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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1.26E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from cat urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413039
PNG
(CHEMBL447747)
Show SMILES CCNc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C13H13N3/c1-2-14-13-12-9-5-3-4-6-10(9)16-11(12)7-8-15-13/h3-8,16H,2H2,1H3,(H,14,15)
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1.58E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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


(Felis catus)
BDBM50413019
PNG
(CHEMBL495937)
Show SMILES CC(C)CCNc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C16H19N3/c1-11(2)7-9-17-16-15-12-5-3-4-6-13(12)19-14(15)8-10-18-16/h3-6,8,10-11,19H,7,9H2,1-2H3,(H,17,18)
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1.58E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from cat urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413024
PNG
(CHEMBL505617)
Show SMILES C1CC1Nc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C14H13N3/c1-2-4-11-10(3-1)13-12(17-11)7-8-15-14(13)16-9-5-6-9/h1-4,7-9,17H,5-6H2,(H,15,16)
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2.51E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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


(Felis catus)
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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2.51E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from cat urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413034
PNG
(CHEMBL495919)
Show SMILES CCCCNc1nccc2n(Cc3ccccc3)c3ccccc3c12
Show InChI InChI=1S/C22H23N3/c1-2-3-14-23-22-21-18-11-7-8-12-19(18)25(20(21)13-15-24-22)16-17-9-5-4-6-10-17/h4-13,15H,2-3,14,16H2,1H3,(H,23,24)
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3.98E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413029
PNG
(CHEMBL495908)
Show SMILES CN(C)CCNc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C15H18N4/c1-19(2)10-9-17-15-14-11-5-3-4-6-12(11)18-13(14)7-8-16-15/h3-8,18H,9-10H2,1-2H3,(H,16,17)
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>7.94E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413040
PNG
(CHEMBL497764)
Show SMILES N(c1ccccc1)c1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C17H13N3/c1-2-6-12(7-3-1)19-17-16-13-8-4-5-9-14(13)20-15(16)10-11-18-17/h1-11,20H,(H,18,19)
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>7.94E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413025
PNG
(CHEMBL524805)
Show SMILES C1CCC(CC1)Nc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C17H19N3/c1-2-6-12(7-3-1)19-17-16-13-8-4-5-9-14(13)20-15(16)10-11-18-17/h4-5,8-12,20H,1-3,6-7H2,(H,18,19)
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>7.94E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413044
PNG
(CHEMBL451255)
Show SMILES COCCN(C)c1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C15H17N3O/c1-18(9-10-19-2)15-14-11-5-3-4-6-12(11)17-13(14)7-8-16-15/h3-8,17H,9-10H2,1-2H3
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>7.94E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413043
PNG
(CHEMBL498174)
Show SMILES C(CN1CCOCC1)Nc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C17H20N4O/c1-2-4-14-13(3-1)16-15(20-14)5-6-18-17(16)19-7-8-21-9-11-22-12-10-21/h1-6,20H,7-12H2,(H,18,19)
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>7.94E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413031
PNG
(CHEMBL445829)
Show SMILES NC(=O)CCNc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C14H14N4O/c15-12(19)6-8-17-14-13-9-3-1-2-4-10(9)18-11(13)5-7-16-14/h1-5,7,18H,6,8H2,(H2,15,19)(H,16,17)
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>7.94E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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))
BDBM50413030
PNG
(CHEMBL498175)
Show SMILES CC(=O)NCCNc1nccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C15H16N4O/c1-10(20)16-8-9-18-15-14-11-4-2-3-5-12(11)19-13(14)6-7-17-15/h2-7,19H,8-9H2,1H3,(H,16,20)(H,17,18)
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>7.94E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]human urotensin 2 from human recombinant urotensin 2 receptor expressed in HEK293 cells


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
Cytochrome P450 2D6


(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/a 7.94n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6


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
Cytochrome P450 3A4


(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/a 100n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4


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/a 501n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant urotensin 2 receptor expressed in HEK293 cells assessed as inhibition of intercellular calcium mobilization ...


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))
BDBM50241425
PNG
(2-((3,4-dichlorophenyl)(methyl)amino)-1-(2-(pyrrol...)
Show SMILES CN(CC(=O)N1CCCCC1CN1CCCC1)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H27Cl2N3O/c1-22(15-7-8-17(20)18(21)12-15)14-19(25)24-11-3-2-6-16(24)13-23-9-4-5-10-23/h7-8,12,16H,2-6,9-11,13-14H2,1H3
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n/an/a 631n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of human recombinant urotensin 2 receptor-mediated calcium mobilization expressed in HEK293 cells by FLIPR assay


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
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50239135
PNG
(2-((3,4-dichlorophenyl)(methyl)amino)-1-((2R,3R)-3...)
Show SMILES CN(CC(=O)N1CCC[C@@H]([C@@H]1CN1CCCC1)c1ccccc1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C25H31Cl2N3O/c1-28(20-11-12-22(26)23(27)16-20)18-25(31)30-15-7-10-21(19-8-3-2-4-9-19)24(30)17-29-13-5-6-14-29/h2-4,8-9,11-12,16,21,24H,5-7,10,13-15,17-18H2,1H3/t21-,24+/m1/s1
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n/an/a 800n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6


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
Cytochrome P450 3A4


(Homo sapiens (Human))
BDBM50239135
PNG
(2-((3,4-dichlorophenyl)(methyl)amino)-1-((2R,3R)-3...)
Show SMILES CN(CC(=O)N1CCC[C@@H]([C@@H]1CN1CCCC1)c1ccccc1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C25H31Cl2N3O/c1-28(20-11-12-22(26)23(27)16-20)18-25(31)30-15-7-10-21(19-8-3-2-4-9-19)24(30)17-29-13-5-6-14-29/h2-4,8-9,11-12,16,21,24H,5-7,10,13-15,17-18H2,1H3/t21-,24+/m1/s1
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n/an/a 1.40E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4


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
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