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PubMed code 26363507

Compile data set for download or QSAR
Found 88 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
Cytochrome P450 3A4


(Homo sapiens (Human))		BDBM50499447
PNG
(CHEMBL3739521)
Show SMILES CC(C)N1CCC(CC1)NC(=O)c1nc(C(C)C)n2ccccc12
Show InChI InChI=1S/C19H28N4O/c1-13(2)18-21-17(16-7-5-6-10-23(16)18)19(24)20-15-8-11-22(12-9-15)14(3)4/h5-7,10,13-15H,8-9,11-12H2,1-4H3,(H,20,24)
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n/an/a 200n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate after 2 mins by LC-MS/MS analysis in presence of NADPH regeneration syste...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Homo sapiens (Human))		BDBM50499430
PNG
(CHEMBL3740472)
Show SMILES [H][C@@]12CN(CCCOC)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C21H30N4O2/c1-14(2)20-23-19(18-7-4-5-9-25(18)20)21(26)22-11-15-16-12-24(13-17(15)16)8-6-10-27-3/h4-5,7,9,14-17H,6,8,10-13H2,1-3H3,(H,22,26)/t15-,16-,17+
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n/an/a 200n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate after 2 mins by LC-MS/MS analysis in presence of NADPH regeneration syste...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM50499430
PNG
(CHEMBL3740472)
Show SMILES [H][C@@]12CN(CCCOC)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C21H30N4O2/c1-14(2)20-23-19(18-7-4-5-9-25(18)20)21(26)22-11-15-16-12-24(13-17(15)16)8-6-10-27-3/h4-5,7,9,14-17H,6,8,10-13H2,1-3H3,(H,22,26)/t15-,16-,17+
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n/an/a 5.10E+3n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel expressed in HEK293 cells after 5 mins by patch clamp assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))		BDBM50499445
PNG
(CHEMBL3741608)
Show SMILES CC(C)c1nc(C(=O)NCC2CCN(CC3CCOCC3)CC2)c2ccccn12
Show InChI InChI=1S/C23H34N4O2/c1-17(2)22-25-21(20-5-3-4-10-27(20)22)23(28)24-15-18-6-11-26(12-7-18)16-19-8-13-29-14-9-19/h3-5,10,17-19H,6-9,11-16H2,1-2H3,(H,24,28)
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n/an/a 7.50E+3n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6 in human liver microsomes using dextromethorphan as substrate after 12 mins by LC-MS/MS analysis in presence of NADPH regenerati...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Homo sapiens (Human))		BDBM50499450
PNG
(CHEMBL3741776)
Show SMILES COCCCN1CCC(CC1)NC(=O)c1nc(C(C)C)n2ccccc12
Show InChI InChI=1S/C20H30N4O2/c1-15(2)19-22-18(17-7-4-5-11-24(17)19)20(25)21-16-8-12-23(13-9-16)10-6-14-26-3/h4-5,7,11,15-16H,6,8-10,12-14H2,1-3H3,(H,21,25)
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n/an/a 1.63E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate after 2 mins by LC-MS/MS analysis in presence of NADPH regeneration syste...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Homo sapiens (Human))		BDBM50499428
PNG
(CHEMBL3741377)
Show SMILES [H][C@@]12CN(CC(C)(C)O)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C21H30N4O2/c1-13(2)19-23-18(17-7-5-6-8-25(17)19)20(26)22-9-14-15-10-24(11-16(14)15)12-21(3,4)27/h5-8,13-16,27H,9-12H2,1-4H3,(H,22,26)/t14-,15-,16+
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n/an/a 1.89E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate after 2 mins by LC-MS/MS analysis in presence of NADPH regeneration syste...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Homo sapiens (Human))		BDBM50499437
PNG
(CHEMBL3739470)
Show SMILES CC(C)c1nc(C(=O)NC2CCN(CC3CC3)CC2)c2ccccn12
Show InChI InChI=1S/C20H28N4O/c1-14(2)19-22-18(17-5-3-4-10-24(17)19)20(25)21-16-8-11-23(12-9-16)13-15-6-7-15/h3-5,10,14-16H,6-9,11-13H2,1-2H3,(H,21,25)
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n/an/a 2.00E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate after 2 mins by LC-MS/MS analysis in presence of NADPH regeneration syste...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))		BDBM50499430
PNG
(CHEMBL3740472)
Show SMILES [H][C@@]12CN(CCCOC)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C21H30N4O2/c1-14(2)20-23-19(18-7-4-5-9-25(18)20)21(26)22-11-15-16-12-24(13-17(15)16)8-6-10-27-3/h4-5,7,9,14-17H,6,8,10-13H2,1-3H3,(H,22,26)/t15-,16-,17+
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n/an/a 2.19E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6 in human liver microsomes using dextromethorphan as substrate after 12 mins by LC-MS/MS analysis in presence of NADPH regenerati...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Homo sapiens (Human))		BDBM50499445
PNG
(CHEMBL3741608)
Show SMILES CC(C)c1nc(C(=O)NCC2CCN(CC3CCOCC3)CC2)c2ccccn12
Show InChI InChI=1S/C23H34N4O2/c1-17(2)22-25-21(20-5-3-4-10-27(20)22)23(28)24-15-18-6-11-26(12-7-18)16-19-8-13-29-14-9-19/h3-5,10,17-19H,6-9,11-16H2,1-2H3,(H,24,28)
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n/an/a 2.55E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate after 2 mins by LC-MS/MS analysis in presence of NADPH regeneration syste...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Homo sapiens (Human))		BDBM50499455
PNG
(CHEMBL3741821)
Show SMILES COCCCN1CCC(CNC(=O)c2nc(C(C)C)n3ccccc23)CC1
Show InChI InChI=1S/C21H32N4O2/c1-16(2)20-23-19(18-7-4-5-11-25(18)20)21(26)22-15-17-8-12-24(13-9-17)10-6-14-27-3/h4-5,7,11,16-17H,6,8-10,12-15H2,1-3H3,(H,22,26)
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n/an/a 2.72E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate after 2 mins by LC-MS/MS analysis in presence of NADPH regeneration syste...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Homo sapiens (Human))		BDBM50499448
PNG
(CHEMBL3740908)
Show SMILES CC(C)c1nc(C(=O)NC2CCN(CCF)CC2)c2ccccn12
Show InChI InChI=1S/C18H25FN4O/c1-13(2)17-21-16(15-5-3-4-9-23(15)17)18(24)20-14-6-10-22(11-7-14)12-8-19/h3-5,9,13-14H,6-8,10-12H2,1-2H3,(H,20,24)
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n/an/a 2.73E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate after 2 mins by LC-MS/MS analysis in presence of NADPH regeneration syste...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))		BDBM50499450
PNG
(CHEMBL3741776)
Show SMILES COCCCN1CCC(CC1)NC(=O)c1nc(C(C)C)n2ccccc12
Show InChI InChI=1S/C20H30N4O2/c1-15(2)19-22-18(17-7-4-5-11-24(17)19)20(25)21-16-8-12-23(13-9-16)10-6-14-26-3/h4-5,7,11,15-16H,6,8-10,12-14H2,1-3H3,(H,21,25)
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n/an/a 3.61E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6 in human liver microsomes using dextromethorphan as substrate after 12 mins by LC-MS/MS analysis in presence of NADPH regenerati...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Homo sapiens (Human))		BDBM50499434
PNG
(CHEMBL3739647)
Show SMILES [H][C@@]12CN(CC3CCOCC3)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C23H32N4O2/c1-15(2)22-25-21(20-5-3-4-8-27(20)22)23(28)24-11-17-18-13-26(14-19(17)18)12-16-6-9-29-10-7-16/h3-5,8,15-19H,6-7,9-14H2,1-2H3,(H,24,28)/t17-,18-,19+
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n/an/a 4.14E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate after 2 mins by LC-MS/MS analysis in presence of NADPH regeneration syste...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))		BDBM50499428
PNG
(CHEMBL3741377)
Show SMILES [H][C@@]12CN(CC(C)(C)O)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C21H30N4O2/c1-13(2)19-23-18(17-7-5-6-8-25(17)19)20(26)22-9-14-15-10-24(11-16(14)15)12-21(3,4)27/h5-8,13-16,27H,9-12H2,1-4H3,(H,22,26)/t14-,15-,16+
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n/an/a 4.37E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6 in human liver microsomes using dextromethorphan as substrate after 12 mins by LC-MS/MS analysis in presence of NADPH regenerati...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Homo sapiens (Human))		BDBM50499432
PNG
(CHEMBL3741595)
Show SMILES [H][C@@]12CN(CC(C)(C)F)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C21H29FN4O/c1-13(2)19-24-18(17-7-5-6-8-26(17)19)20(27)23-9-14-15-10-25(11-16(14)15)12-21(3,4)22/h5-8,13-16H,9-12H2,1-4H3,(H,23,27)/t14-,15-,16+
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n/an/a 4.47E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate after 2 mins by LC-MS/MS analysis in presence of NADPH regeneration syste...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))		BDBM50499455
PNG
(CHEMBL3741821)
Show SMILES COCCCN1CCC(CNC(=O)c2nc(C(C)C)n3ccccc23)CC1
Show InChI InChI=1S/C21H32N4O2/c1-16(2)20-23-19(18-7-4-5-11-25(18)20)21(26)22-15-17-8-12-24(13-9-17)10-6-14-27-3/h4-5,7,11,16-17H,6,8-10,12-15H2,1-3H3,(H,22,26)
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n/an/a 4.86E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6 in human liver microsomes using dextromethorphan as substrate after 12 mins by LC-MS/MS analysis in presence of NADPH regenerati...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))		BDBM50499447
PNG
(CHEMBL3739521)
Show SMILES CC(C)N1CCC(CC1)NC(=O)c1nc(C(C)C)n2ccccc12
Show InChI InChI=1S/C19H28N4O/c1-13(2)18-21-17(16-7-5-6-10-23(16)18)19(24)20-15-8-11-22(12-9-15)14(3)4/h5-7,10,13-15H,8-9,11-12H2,1-4H3,(H,20,24)
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n/an/a 5.04E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6 in human liver microsomes using dextromethorphan as substrate after 12 mins by LC-MS/MS analysis in presence of NADPH regenerati...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Homo sapiens (Human))		BDBM50499446
PNG
(CHEMBL3740669)
Show SMILES [H][C@@]12CN(CC3CCN(CC3)C(=O)OC)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C25H35N5O3/c1-16(2)23-27-22(21-6-4-5-9-30(21)23)24(31)26-12-18-19-14-28(15-20(18)19)13-17-7-10-29(11-8-17)25(32)33-3/h4-6,9,16-20H,7-8,10-15H2,1-3H3,(H,26,31)/t18-,19-,20+
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n/an/a 5.43E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate after 2 mins by LC-MS/MS analysis in presence of NADPH regeneration syste...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))		BDBM50499446
PNG
(CHEMBL3740669)
Show SMILES [H][C@@]12CN(CC3CCN(CC3)C(=O)OC)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C25H35N5O3/c1-16(2)23-27-22(21-6-4-5-9-30(21)23)24(31)26-12-18-19-14-28(15-20(18)19)13-17-7-10-29(11-8-17)25(32)33-3/h4-6,9,16-20H,7-8,10-15H2,1-3H3,(H,26,31)/t18-,19-,20+
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n/an/a 8.85E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6 in human liver microsomes using dextromethorphan as substrate after 12 mins by LC-MS/MS analysis in presence of NADPH regenerati...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))		BDBM50499434
PNG
(CHEMBL3739647)
Show SMILES [H][C@@]12CN(CC3CCOCC3)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C23H32N4O2/c1-15(2)22-25-21(20-5-3-4-8-27(20)22)23(28)24-11-17-18-13-26(14-19(17)18)12-16-6-9-29-10-7-16/h3-5,8,15-19H,6-7,9-14H2,1-2H3,(H,24,28)/t17-,18-,19+
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n/an/a 9.02E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6 in human liver microsomes using dextromethorphan as substrate after 12 mins by LC-MS/MS analysis in presence of NADPH regenerati...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))		BDBM50499448
PNG
(CHEMBL3740908)
Show SMILES CC(C)c1nc(C(=O)NC2CCN(CCF)CC2)c2ccccn12
Show InChI InChI=1S/C18H25FN4O/c1-13(2)17-21-16(15-5-3-4-9-23(15)17)18(24)20-14-6-10-22(11-7-14)12-8-19/h3-5,9,13-14H,6-8,10-12H2,1-2H3,(H,20,24)
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n/an/a 9.35E+4n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6 in human liver microsomes using dextromethorphan as substrate after 12 mins by LC-MS/MS analysis in presence of NADPH regenerati...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))		BDBM50499437
PNG
(CHEMBL3739470)
Show SMILES CC(C)c1nc(C(=O)NC2CCN(CC3CC3)CC2)c2ccccn12
Show InChI InChI=1S/C20H28N4O/c1-14(2)19-22-18(17-5-3-4-10-24(17)19)20(25)21-16-8-11-23(12-9-16)13-15-6-7-15/h3-5,10,14-16H,6-9,11-13H2,1-2H3,(H,21,25)
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n/an/a 1.40E+5n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6 in human liver microsomes using dextromethorphan as substrate after 12 mins by LC-MS/MS analysis in presence of NADPH regenerati...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))		BDBM50499432
PNG
(CHEMBL3741595)
Show SMILES [H][C@@]12CN(CC(C)(C)F)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C21H29FN4O/c1-13(2)19-24-18(17-7-5-6-8-26(17)19)20(27)23-9-14-15-10-25(11-16(14)15)12-21(3,4)22/h5-8,13-16H,9-12H2,1-4H3,(H,23,27)/t14-,15-,16+
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n/an/a 7.34E+5n/an/an/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6 in human liver microsomes using dextromethorphan as substrate after 12 mins by LC-MS/MS analysis in presence of NADPH regenerati...

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(RAT)		BDBM50122872
PNG
(4-Amino-5-chloro-2,3-dihydro-benzofuran-7-carboxyl...)
Show SMILES COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(N)c2CCOc12
Show InChI InChI=1S/C18H26ClN3O3/c1-24-9-2-6-22-7-3-12(4-8-22)21-18(23)14-11-15(19)16(20)13-5-10-25-17(13)14/h11-12H,2-10,20H2,1H3,(H,21,23)
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n/an/an/an/a 26n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at rat 5HT4e receptor expressed in HEK293 cells assessed as cAMP level after 30 mins by HTRF assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50456116
PNG
(Prx-03140)
Show SMILES CC(C)n1c2sccc2c(O)c(C(=O)NCCCN2CCCCC2)c1=O
Show InChI InChI=1S/C19H27N3O3S/c1-13(2)22-18(25)15(16(23)14-7-12-26-19(14)22)17(24)20-8-6-11-21-9-4-3-5-10-21/h7,12-13,23H,3-6,8-11H2,1-2H3,(H,20,24)
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n/an/an/an/a 58n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499433
PNG
(CHEMBL3740612)
Show SMILES [H][C@@]12CN(C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12)C1CCOCC1 |r|
Show InChI InChI=1S/C22H30N4O2/c1-14(2)21-24-20(19-5-3-4-8-26(19)21)22(27)23-11-16-17-12-25(13-18(16)17)15-6-9-28-10-7-15/h3-5,8,14-18H,6-7,9-13H2,1-2H3,(H,23,27)/t16-,17-,18+
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n/an/an/an/a 21n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499436
PNG
(CHEMBL3739611)
Show SMILES CC(C)c1nc(C(=O)NC2CCN(CC(C)(C)O)CC2)c2ccccn12
Show InChI InChI=1S/C20H30N4O2/c1-14(2)18-22-17(16-7-5-6-10-24(16)18)19(25)21-15-8-11-23(12-9-15)13-20(3,4)26/h5-7,10,14-15,26H,8-9,11-13H2,1-4H3,(H,21,25)
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n/an/an/an/a 40n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499442
PNG
(CHEMBL3740278)
Show SMILES CC(C)c1nc(C(=O)NCC2(F)CCN(CC3CCOCC3)CC2)c2ccccn12
Show InChI InChI=1S/C23H33FN4O2/c1-17(2)21-26-20(19-5-3-4-10-28(19)21)22(29)25-16-23(24)8-11-27(12-9-23)15-18-6-13-30-14-7-18/h3-5,10,17-18H,6-9,11-16H2,1-2H3,(H,25,29)
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n/an/an/an/a 1.36E+3n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499444
PNG
(CHEMBL3741733)
Show SMILES CC(C)c1nc(C(=O)NCC2CCN(CC2)C2CCC2)c2ccccn12
Show InChI InChI=1S/C21H30N4O/c1-15(2)20-23-19(18-8-3-4-11-25(18)20)21(26)22-14-16-9-12-24(13-10-16)17-6-5-7-17/h3-4,8,11,15-17H,5-7,9-10,12-14H2,1-2H3,(H,22,26)
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n/an/an/an/a 9.80n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499453
PNG
(CHEMBL3742190)
Show SMILES COCCN1CCC(CC1)NC(=O)c1nc(C(C)C)n2ccccc12
Show InChI InChI=1S/C19H28N4O2/c1-14(2)18-21-17(16-6-4-5-9-23(16)18)19(24)20-15-7-10-22(11-8-15)12-13-25-3/h4-6,9,14-15H,7-8,10-13H2,1-3H3,(H,20,24)
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n/an/an/an/a 144n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50398598
PNG
(CHEMBL2152922)
Show SMILES OC1(CN2CCC(COc3noc4cccc(O[C@@H]5CCOC5)c34)CC2)CCOCC1 |r|
Show InChI InChI=1S/C23H32N2O6/c26-23(7-12-27-13-8-23)16-25-9-4-17(5-10-25)14-29-22-21-19(30-18-6-11-28-15-18)2-1-3-20(21)31-24-22/h1-3,17-18,26H,4-16H2/t18-/m1/s1
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n/an/an/an/a 1.30n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499464
PNG
(CHEMBL3741322)
Show SMILES CC(C)c1nc(C(=O)NC2CCN(CC2)C2CCOCC2)c2ccccn12
Show InChI InChI=1S/C21H30N4O2/c1-15(2)20-23-19(18-5-3-4-10-25(18)20)21(26)22-16-6-11-24(12-7-16)17-8-13-27-14-9-17/h3-5,10,15-17H,6-9,11-14H2,1-2H3,(H,22,26)
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n/an/an/an/a 49n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499466
PNG
(CHEMBL3739689)
Show SMILES CC(C)c1nc(C(=O)NC2C3CN(CC4CCOCC4)CC23)c2ccccn12 |@:9|
Show InChI InChI=1S/C22H30N4O2/c1-14(2)21-23-20(18-5-3-4-8-26(18)21)22(27)24-19-16-12-25(13-17(16)19)11-15-6-9-28-10-7-15/h3-5,8,14-17,19H,6-7,9-13H2,1-2H3,(H,24,27)
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n/an/an/an/a 1.06E+3n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499468
PNG
(CHEMBL3741376)
Show SMILES CC(C)n1c2ccccc2n(C(=O)NCC2CCN(CC3(O)CCOCC3)CC2)c1=O
Show InChI InChI=1S/C23H34N4O4/c1-17(2)26-19-5-3-4-6-20(19)27(22(26)29)21(28)24-15-18-7-11-25(12-8-18)16-23(30)9-13-31-14-10-23/h3-6,17-18,30H,7-16H2,1-2H3,(H,24,28)
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n/an/an/an/a 0.5n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499427
PNG
(CHEMBL3741826)
Show SMILES CC(C)c1nc(C(=O)NC2CCN(CC3CCC3)CC2)c2ccccn12
Show InChI InChI=1S/C21H30N4O/c1-15(2)20-23-19(18-8-3-4-11-25(18)20)21(26)22-17-9-12-24(13-10-17)14-16-6-5-7-16/h3-4,8,11,15-17H,5-7,9-10,12-14H2,1-2H3,(H,22,26)
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n/an/an/an/a 16n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499430
PNG
(CHEMBL3740472)
Show SMILES [H][C@@]12CN(CCCOC)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C21H30N4O2/c1-14(2)20-23-19(18-7-4-5-9-25(18)20)21(26)22-11-15-16-12-24(13-17(15)16)8-6-10-27-3/h4-5,7,9,14-17H,6,8,10-13H2,1-3H3,(H,22,26)/t15-,16-,17+
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n/an/an/an/a 20n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5-HT4D receptor assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(RAT)		BDBM84950
PNG
(CAS_183782 | NSC_183782 | RS 67333)
Show SMILES CCCCN1CCC(CCC(=O)c2cc(Cl)c(N)cc2OC)CC1
Show InChI InChI=1S/C19H29ClN2O2/c1-3-4-9-22-10-7-14(8-11-22)5-6-18(23)15-12-16(20)17(21)13-19(15)24-2/h12-14H,3-11,21H2,1-2H3
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n/an/an/an/a 8.70n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at 5-HT4 receptor in Sprague-Dawley rat oesophagus assessed as relaxation of carbachol precontracted oesophagus

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499456
PNG
(CHEMBL3741548)
Show SMILES [H][C@@]12CN(CC(C)(C)CO)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C22H32N4O2/c1-14(2)20-24-19(18-7-5-6-8-26(18)20)21(28)23-9-15-16-10-25(11-17(15)16)12-22(3,4)13-27/h5-8,14-17,27H,9-13H2,1-4H3,(H,23,28)/t15-,16-,17+
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n/an/an/an/a 5.70n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499463
PNG
(CHEMBL3740400)
Show SMILES CCN1CCC(CC1)NC(=O)c1nc(C(C)C)n2ccccc12
Show InChI InChI=1S/C18H26N4O/c1-4-21-11-8-14(9-12-21)19-18(23)16-15-7-5-6-10-22(15)17(20-16)13(2)3/h5-7,10,13-14H,4,8-9,11-12H2,1-3H3,(H,19,23)
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n/an/an/an/a 50n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499472
PNG
(CHEMBL3740708)
Show SMILES CC(C)c1nc(C(=O)NC2CCN(CC3(O)CCOCC3)CC2)c2ccccn12
Show InChI InChI=1S/C22H32N4O3/c1-16(2)20-24-19(18-5-3-4-10-26(18)20)21(27)23-17-6-11-25(12-7-17)15-22(28)8-13-29-14-9-22/h3-5,10,16-17,28H,6-9,11-15H2,1-2H3,(H,23,27)
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n/an/an/an/a 144n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499438
PNG
(CHEMBL3739467)
Show SMILES COCCCN1CCC(CC1)c1nnc(o1)-c1nc(C(C)C)n2ccccc12
Show InChI InChI=1S/C21H29N5O2/c1-15(2)19-22-18(17-7-4-5-11-26(17)19)21-24-23-20(28-21)16-8-12-25(13-9-16)10-6-14-27-3/h4-5,7,11,15-16H,6,8-10,12-14H2,1-3H3
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n/an/an/an/a 736n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499445
PNG
(CHEMBL3741608)
Show SMILES CC(C)c1nc(C(=O)NCC2CCN(CC3CCOCC3)CC2)c2ccccn12
Show InChI InChI=1S/C23H34N4O2/c1-17(2)22-25-21(20-5-3-4-10-27(20)22)23(28)24-15-18-6-11-26(12-7-18)16-19-8-13-29-14-9-19/h3-5,10,17-19H,6-9,11-16H2,1-2H3,(H,24,28)
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n/an/an/an/a 10n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(RAT)		BDBM10755
PNG
(14C-5-hydroxy tryptamine creatinine disulfate | 2-...)
Show SMILES NCCc1c[nH]c2ccc(O)cc12
Show InChI InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2
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n/an/an/an/a 4.20n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at 5HT2b receptor in Wistar rat fundus measured for 90 secs

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499450
PNG
(CHEMBL3741776)
Show SMILES COCCCN1CCC(CC1)NC(=O)c1nc(C(C)C)n2ccccc12
Show InChI InChI=1S/C20H30N4O2/c1-15(2)19-22-18(17-7-4-5-11-24(17)19)20(25)21-16-8-12-23(13-9-16)10-6-14-26-3/h4-5,7,11,15-16H,6,8-10,12-14H2,1-3H3,(H,21,25)
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n/an/an/an/a 40n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499451
PNG
(CHEMBL3741199)
Show SMILES CC(C)c1nc(-c2nnc(o2)C2CCN(CC2)C2CCC2)c2ccccn12
Show InChI InChI=1S/C21H27N5O/c1-14(2)19-22-18(17-8-3-4-11-26(17)19)21-24-23-20(27-21)15-9-12-25(13-10-15)16-6-5-7-16/h3-4,8,11,14-16H,5-7,9-10,12-13H2,1-2H3
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n/an/an/an/a 840n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM84950
PNG
(CAS_183782 | NSC_183782 | RS 67333)
Show SMILES CCCCN1CCC(CCC(=O)c2cc(Cl)c(N)cc2OC)CC1
Show InChI InChI=1S/C19H29ClN2O2/c1-3-4-9-22-10-7-14(8-11-22)5-6-18(23)15-12-16(20)17(21)13-19(15)24-2/h12-14H,3-11,21H2,1-2H3
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n/an/an/an/a 2n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499457
PNG
(CHEMBL3741787)
Show SMILES [H][C@@]12CN(C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12)C1CCN(CC1)C(=O)OC |r|
Show InChI InChI=1S/C24H33N5O3/c1-15(2)22-26-21(20-6-4-5-9-29(20)22)23(30)25-12-17-18-13-28(14-19(17)18)16-7-10-27(11-8-16)24(31)32-3/h4-6,9,15-19H,7-8,10-14H2,1-3H3,(H,25,30)/t17-,18-,19+
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n/an/an/an/a 9.70n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499430
PNG
(CHEMBL3740472)
Show SMILES [H][C@@]12CN(CCCOC)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C21H30N4O2/c1-14(2)20-23-19(18-7-4-5-9-25(18)20)21(26)22-11-15-16-12-24(13-17(15)16)8-6-10-27-3/h4-5,7,9,14-17H,6,8,10-13H2,1-3H3,(H,22,26)/t15-,16-,17+
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n/an/an/an/a 22n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499448
PNG
(CHEMBL3740908)
Show SMILES CC(C)c1nc(C(=O)NC2CCN(CCF)CC2)c2ccccn12
Show InChI InChI=1S/C18H25FN4O/c1-13(2)17-21-16(15-5-3-4-9-23(15)17)18(24)20-14-6-10-22(11-7-14)12-8-19/h3-5,9,13-14H,6-8,10-12H2,1-2H3,(H,20,24)
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n/an/an/an/a 3.90n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499465
PNG
(CHEMBL3741224)
Show SMILES [H][C@@]12CN(CC3CCC3)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C22H30N4O/c1-14(2)21-24-20(19-8-3-4-9-26(19)21)22(27)23-10-16-17-12-25(13-18(16)17)11-15-6-5-7-15/h3-4,8-9,14-18H,5-7,10-13H2,1-2H3,(H,23,27)/t16-,17-,18+
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n/an/an/an/a 13n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50436989
PNG
(CHEMBL2402904)
Show SMILES COC(=O)N1CCC(CN2CCC(CNC(=O)c3cccc4nc([nH]c34)C(C)C)CC2)CC1
Show InChI InChI=1S/C25H37N5O3/c1-17(2)23-27-21-6-4-5-20(22(21)28-23)24(31)26-15-18-7-11-29(12-8-18)16-19-9-13-30(14-10-19)25(32)33-3/h4-6,17-19H,7-16H2,1-3H3,(H,26,31)(H,27,28)
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n/an/an/an/a 1.5n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499429
PNG
(CHEMBL3739455)
Show SMILES CC(C)c1nc(-c2nnc(o2)C2CCN(CC3CCC3)CC2)c2ccccn12
Show InChI InChI=1S/C22H29N5O/c1-15(2)20-23-19(18-8-3-4-11-27(18)20)22-25-24-21(28-22)17-9-12-26(13-10-17)14-16-6-5-7-16/h3-4,8,11,15-17H,5-7,9-10,12-14H2,1-2H3
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n/an/an/an/a 520n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499440
PNG
(CHEMBL3741062)
Show SMILES CC(C)c1nc(C(=O)NCC2(C)CCN(CC3CCOCC3)CC2)c2ccccn12
Show InChI InChI=1S/C24H36N4O2/c1-18(2)22-26-21(20-6-4-5-11-28(20)22)23(29)25-17-24(3)9-12-27(13-10-24)16-19-7-14-30-15-8-19/h4-6,11,18-19H,7-10,12-17H2,1-3H3,(H,25,29)
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n/an/an/an/a 53n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)		BDBM29526
PNG
(2-Piperidinoethyl 4-amino-5-chloro-2-methoxybenzoa...)
Show SMILES COc1cc(N)c(Cl)cc1C(=O)OCCN1CCCCC1
Show InChI InChI=1S/C15H21ClN2O3/c1-20-14-10-13(17)12(16)9-11(14)15(19)21-8-7-18-5-3-2-4-6-18/h9-10H,2-8,17H2,1H3
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n/an/an/an/a 4n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at 5-HT4 receptor in guinea pig ileum assessed as increase in response to electrical stimulation

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499446
PNG
(CHEMBL3740669)
Show SMILES [H][C@@]12CN(CC3CCN(CC3)C(=O)OC)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C25H35N5O3/c1-16(2)23-27-22(21-6-4-5-9-30(21)23)24(31)26-12-18-19-14-28(15-20(18)19)13-17-7-10-29(11-8-17)25(32)33-3/h4-6,9,16-20H,7-8,10-15H2,1-3H3,(H,26,31)/t18-,19-,20+
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n/an/an/an/a 8.70n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499462
PNG
(CHEMBL3740313)
Show SMILES CC(C)N1CCC(CC1)c1nnc(o1)-c1nc(C(C)C)n2ccccc12
Show InChI InChI=1S/C20H27N5O/c1-13(2)18-21-17(16-7-5-6-10-25(16)18)20-23-22-19(26-20)15-8-11-24(12-9-15)14(3)4/h5-7,10,13-15H,8-9,11-12H2,1-4H3
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n/an/an/an/a 500n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(RAT)		BDBM50499430
PNG
(CHEMBL3740472)
Show SMILES [H][C@@]12CN(CCCOC)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C21H30N4O2/c1-14(2)20-23-19(18-7-4-5-9-25(18)20)21(26)22-11-15-16-12-24(13-17(15)16)8-6-10-27-3/h4-5,7,9,14-17H,6,8,10-13H2,1-3H3,(H,22,26)/t15-,16-,17+
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n/an/an/an/a 20n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at rat 5-HT4L receptor assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499470
PNG
(CHEMBL3739931)
Show SMILES [H][C@@]12CN(C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12)C1CCC1 |r|
Show InChI InChI=1S/C21H28N4O/c1-13(2)20-23-19(18-8-3-4-9-25(18)20)21(26)22-10-15-16-11-24(12-17(15)16)14-6-5-7-14/h3-4,8-9,13-17H,5-7,10-12H2,1-2H3,(H,22,26)/t15-,16-,17+
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n/an/an/an/a 18n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499432
PNG
(CHEMBL3741595)
Show SMILES [H][C@@]12CN(CC(C)(C)F)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C21H29FN4O/c1-13(2)19-24-18(17-7-5-6-8-26(17)19)20(27)23-9-14-15-10-25(11-16(14)15)12-21(3,4)22/h5-8,13-16H,9-12H2,1-4H3,(H,23,27)/t14-,15-,16+
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n/an/an/an/a 18n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499437
PNG
(CHEMBL3739470)
Show SMILES CC(C)c1nc(C(=O)NC2CCN(CC3CC3)CC2)c2ccccn12
Show InChI InChI=1S/C20H28N4O/c1-14(2)19-22-18(17-5-3-4-10-24(17)19)20(25)21-16-8-11-23(12-9-16)13-15-6-7-15/h3-5,10,14-16H,6-9,11-13H2,1-2H3,(H,21,25)
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n/an/an/an/a 49n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499439
PNG
(CHEMBL3740000)
Show SMILES CC(C)c1nc(-c2nnc(o2)C2CCN(CC3CC3)CC2)c2ccccn12
Show InChI InChI=1S/C21H27N5O/c1-14(2)19-22-18(17-5-3-4-10-26(17)19)21-24-23-20(27-21)16-8-11-25(12-9-16)13-15-6-7-15/h3-5,10,14-16H,6-9,11-13H2,1-2H3
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n/an/an/an/a 857n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499449
PNG
(CHEMBL3742086)
Show SMILES CC(C)c1nc(C(=O)NC2CCN(CC(C)(C)F)CC2)c2ccccn12
Show InChI InChI=1S/C20H29FN4O/c1-14(2)18-23-17(16-7-5-6-10-25(16)18)19(26)22-15-8-11-24(12-9-15)13-20(3,4)21/h5-7,10,14-15H,8-9,11-13H2,1-4H3,(H,22,26)
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n/an/an/an/a 132n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499458
PNG
(CHEMBL3740844)
Show SMILES [H][C@@]12CN(C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12)C(C)C |r|
Show InChI InChI=1S/C20H28N4O/c1-12(2)19-22-18(17-7-5-6-8-24(17)19)20(25)21-9-14-15-10-23(13(3)4)11-16(14)15/h5-8,12-16H,9-11H2,1-4H3,(H,21,25)/t14-,15-,16+
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n/an/an/an/a 18n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499460
PNG
(CHEMBL3741403)
Show SMILES COCCCN1CC2C(C1)C2NC(=O)c1nc(C(C)C)n2ccccc12 |@:10|
Show InChI InChI=1S/C20H28N4O2/c1-13(2)19-21-18(16-7-4-5-9-24(16)19)20(25)22-17-14-11-23(12-15(14)17)8-6-10-26-3/h4-5,7,9,13-15,17H,6,8,10-12H2,1-3H3,(H,22,25)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499461
PNG
(CHEMBL3739933)
Show SMILES COCC(C)(C)CN1CCC(CC1)NC(=O)c1nc(C(C)C)n2ccccc12
Show InChI InChI=1S/C22H34N4O2/c1-16(2)20-24-19(18-8-6-7-11-26(18)20)21(27)23-17-9-12-25(13-10-17)14-22(3,4)15-28-5/h6-8,11,16-17H,9-10,12-15H2,1-5H3,(H,23,27)
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n/an/an/an/a 47n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499467
PNG
(CHEMBL3742080)
Show SMILES CC(C)c1nc(C(=O)NC2CC3CCC(C2)N3CC2(O)CCOCC2)c2ccccn12
Show InChI InChI=1S/C24H34N4O3/c1-16(2)22-26-21(20-5-3-4-10-27(20)22)23(29)25-17-13-18-6-7-19(14-17)28(18)15-24(30)8-11-31-12-9-24/h3-5,10,16-19,30H,6-9,11-15H2,1-2H3,(H,25,29)
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n/an/an/an/a 88n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499425
PNG
(CHEMBL3741508)
Show SMILES CC(C)c1nc(C(=O)NCC2CN(CCO2)C2CCOCC2)c2ccccn12
Show InChI InChI=1S/C21H30N4O3/c1-15(2)20-23-19(18-5-3-4-8-25(18)20)21(26)22-13-17-14-24(9-12-28-17)16-6-10-27-11-7-16/h3-5,8,15-17H,6-7,9-14H2,1-2H3,(H,22,26)
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n/an/an/an/a 467n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499431
PNG
(CHEMBL3740732)
Show SMILES CC(C)c1nc(C(=O)NC2CCN(CC3CCOC3)CC2)c2ccccn12
Show InChI InChI=1S/C21H30N4O2/c1-15(2)20-23-19(18-5-3-4-9-25(18)20)21(26)22-17-6-10-24(11-7-17)13-16-8-12-27-14-16/h3-5,9,15-17H,6-8,10-14H2,1-2H3,(H,22,26)
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n/an/an/an/a 25n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499430
PNG
(CHEMBL3740472)
Show SMILES [H][C@@]12CN(CCCOC)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C21H30N4O2/c1-14(2)20-23-19(18-7-4-5-9-25(18)20)21(26)22-11-15-16-12-24(13-17(15)16)8-6-10-27-3/h4-5,7,9,14-17H,6,8,10-13H2,1-3H3,(H,22,26)/t15-,16-,17+
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n/an/an/an/a 20n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5-HT4A receptor assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499447
PNG
(CHEMBL3739521)
Show SMILES CC(C)N1CCC(CC1)NC(=O)c1nc(C(C)C)n2ccccc12
Show InChI InChI=1S/C19H28N4O/c1-13(2)18-21-17(16-7-5-6-10-23(16)18)19(24)20-15-8-11-22(12-9-15)14(3)4/h5-7,10,13-15H,8-9,11-12H2,1-4H3,(H,20,24)
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n/an/an/an/a 3.40n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499452
PNG
(CHEMBL3740030)
Show SMILES COCCCN1CCC(O)(CNC(=O)c2nc(C(C)C)n3ccccc23)CC1
Show InChI InChI=1S/C21H32N4O3/c1-16(2)19-23-18(17-7-4-5-11-25(17)19)20(26)22-15-21(27)8-12-24(13-9-21)10-6-14-28-3/h4-5,7,11,16,27H,6,8-10,12-15H2,1-3H3,(H,22,26)
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n/an/an/an/a 316n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499454
PNG
(CHEMBL3742145)
Show SMILES CC(C)c1nc(C(=O)NCC2(O)CCN(CC(C)(C)O)CC2)c2ccccn12
Show InChI InChI=1S/C21H32N4O3/c1-15(2)18-23-17(16-7-5-6-10-25(16)18)19(26)22-13-21(28)8-11-24(12-9-21)14-20(3,4)27/h5-7,10,15,27-28H,8-9,11-14H2,1-4H3,(H,22,26)
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n/an/an/an/a 72n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM29526
PNG
(2-Piperidinoethyl 4-amino-5-chloro-2-methoxybenzoa...)
Show SMILES COc1cc(N)c(Cl)cc1C(=O)OCCN1CCCCC1
Show InChI InChI=1S/C15H21ClN2O3/c1-20-14-10-13(17)12(16)9-11(14)15(19)21-8-7-18-5-3-2-4-6-18/h9-10H,2-8,17H2,1H3
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n/an/an/an/a 2.5n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499468
PNG
(CHEMBL3741376)
Show SMILES CC(C)n1c2ccccc2n(C(=O)NCC2CCN(CC3(O)CCOCC3)CC2)c1=O
Show InChI InChI=1S/C23H34N4O4/c1-17(2)26-19-5-3-4-6-20(19)27(22(26)29)21(28)24-15-18-7-11-25(12-8-18)16-23(30)9-13-31-14-10-23/h3-6,17-18,30H,7-16H2,1-2H3,(H,24,28)
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n/an/an/an/a 1.30n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at 5-HT4D receptor (unknown origin)

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50456116
PNG
(Prx-03140)
Show SMILES CC(C)n1c2sccc2c(O)c(C(=O)NCCCN2CCCCC2)c1=O
Show InChI InChI=1S/C19H27N3O3S/c1-13(2)22-18(25)15(16(23)14-7-12-26-19(14)22)17(24)20-8-6-11-21-9-4-3-5-10-21/h7,12-13,23H,3-6,8-11H2,1-2H3,(H,20,24)
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n/an/an/an/a 17n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at recombinant human 5HT4e receptor expressed in African green monkey COS7 cells assessed as cAMP level after 30 mins by HTRF assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499469
PNG
(CHEMBL3739862)
Show SMILES CC(C)c1nc(C(=O)NCC2CCN(CC2)C2CCOCC2)c2ccccn12
Show InChI InChI=1S/C22H32N4O2/c1-16(2)21-24-20(19-5-3-4-10-26(19)21)22(27)23-15-17-6-11-25(12-7-17)18-8-13-28-14-9-18/h3-5,10,16-18H,6-9,11-15H2,1-2H3,(H,23,27)
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n/an/an/an/a 11n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499424
PNG
(CHEMBL3741918)
Show SMILES [H][C@@]12CN(CC(C)(C)COC)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C23H34N4O2/c1-15(2)21-25-20(19-8-6-7-9-27(19)21)22(28)24-10-16-17-11-26(12-18(16)17)13-23(3,4)14-29-5/h6-9,15-18H,10-14H2,1-5H3,(H,24,28)/t16-,17-,18+
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n/an/an/an/a 20n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499426
PNG
(CHEMBL3742300)
Show SMILES CC(C)c1nc(C(=O)NCC2CN(CCO2)C2CCC2)c2ccccn12
Show InChI InChI=1S/C20H28N4O2/c1-14(2)19-22-18(17-8-3-4-9-24(17)19)20(25)21-12-16-13-23(10-11-26-16)15-6-5-7-15/h3-4,8-9,14-16H,5-7,10-13H2,1-2H3,(H,21,25)
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n/an/an/an/a 2.25E+3n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499435
PNG
(CHEMBL3741703)
Show SMILES CC(C)c1nc(C(=O)NC2CCN(CC3(F)CCOCC3)CC2)c2ccccn12
Show InChI InChI=1S/C22H31FN4O2/c1-16(2)20-25-19(18-5-3-4-10-27(18)20)21(28)24-17-6-11-26(12-7-17)15-22(23)8-13-29-14-9-22/h3-5,10,16-17H,6-9,11-15H2,1-2H3,(H,24,28)
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n/an/an/an/a 196n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499441
PNG
(CHEMBL3739459)
Show SMILES CC(C)c1nc(C(=O)NCC2(O)CCN(CC3CCOCC3)CC2)c2ccccn12
Show InChI InChI=1S/C23H34N4O3/c1-17(2)21-25-20(19-5-3-4-10-27(19)21)22(28)24-16-23(29)8-11-26(12-9-23)15-18-6-13-30-14-7-18/h3-5,10,17-18,29H,6-9,11-16H2,1-2H3,(H,24,28)
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n/an/an/an/a 57n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499443
PNG
(CHEMBL3740864)
Show SMILES COCCCN1CCC(F)(CNC(=O)c2nc(C(C)C)n3ccccc23)CC1
Show InChI InChI=1S/C21H31FN4O2/c1-16(2)19-24-18(17-7-4-5-11-26(17)19)20(27)23-15-21(22)8-12-25(13-9-21)10-6-14-28-3/h4-5,7,11,16H,6,8-10,12-15H2,1-3H3,(H,23,27)
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n/an/an/an/a 633n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499434
PNG
(CHEMBL3739647)
Show SMILES [H][C@@]12CN(CC3CCOCC3)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C23H32N4O2/c1-15(2)22-25-21(20-5-3-4-8-27(20)22)23(28)24-11-17-18-13-26(14-19(17)18)12-16-6-9-29-10-7-16/h3-5,8,15-19H,6-7,9-14H2,1-2H3,(H,24,28)/t17-,18-,19+
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n/an/an/an/a 31n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499459
PNG
(CHEMBL3740752)
Show SMILES CC(C)c1nc(C(=O)NC2C3CN(CC(C)(C)O)CC23)c2ccccn12 |@:9|
Show InChI InChI=1S/C20H28N4O2/c1-12(2)18-21-17(15-7-5-6-8-24(15)18)19(25)22-16-13-9-23(10-14(13)16)11-20(3,4)26/h5-8,12-14,16,26H,9-11H2,1-4H3,(H,22,25)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499471
PNG
(CHEMBL3739826)
Show SMILES CC(C)c1nc(C(=O)NC2CC3CCC(C2)N3CC(C)(C)O)c2ccccn12
Show InChI InChI=1S/C22H32N4O2/c1-14(2)20-24-19(18-7-5-6-10-25(18)20)21(27)23-15-11-16-8-9-17(12-15)26(16)13-22(3,4)28/h5-7,10,14-17,28H,8-9,11-13H2,1-4H3,(H,23,27)
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n/an/an/an/a 39n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)		BDBM50436989
PNG
(CHEMBL2402904)
Show SMILES COC(=O)N1CCC(CN2CCC(CNC(=O)c3cccc4nc([nH]c34)C(C)C)CC2)CC1
Show InChI InChI=1S/C25H37N5O3/c1-17(2)23-27-21-6-4-5-20(22(21)28-23)24(31)26-15-18-7-11-29(12-8-18)16-19-9-13-30(14-10-19)25(32)33-3/h4-6,17-19H,7-16H2,1-3H3,(H,26,31)(H,27,28)
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n/an/an/an/a 8.60n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at 5-HT4 receptor in guinea pig colon

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50122872
PNG
(4-Amino-5-chloro-2,3-dihydro-benzofuran-7-carboxyl...)
Show SMILES COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(N)c2CCOc12
Show InChI InChI=1S/C18H26ClN3O3/c1-24-9-2-6-22-7-3-12(4-8-22)21-18(23)14-11-15(19)16(20)13-5-10-25-17(13)14/h11-12H,2-10,20H2,1H3,(H,21,23)
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n/an/an/an/a 5.20n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499428
PNG
(CHEMBL3741377)
Show SMILES [H][C@@]12CN(CC(C)(C)O)C[C@]1([H])[C@H]2CNC(=O)c1nc(C(C)C)n2ccccc12 |r|
Show InChI InChI=1S/C21H30N4O2/c1-13(2)19-23-18(17-7-5-6-8-25(17)19)20(26)22-9-14-15-10-24(11-16(14)15)12-21(3,4)27/h5-8,13-16,27H,9-12H2,1-4H3,(H,22,26)/t14-,15-,16+
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n/an/an/an/a 34n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM50499455
PNG
(CHEMBL3741821)
Show SMILES COCCCN1CCC(CNC(=O)c2nc(C(C)C)n3ccccc23)CC1
Show InChI InChI=1S/C21H32N4O2/c1-16(2)20-23-19(18-7-4-5-11-25(18)20)21(26)22-15-17-8-12-24(13-9-17)10-6-14-27-3/h4-5,7,11,16-17H,6,8-10,12-15H2,1-3H3,(H,22,26)
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n/an/an/an/a 4.80n/an/an/an/a



Suven Life Sciences Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT4e receptor expressed in CHO cells assessed as cAMP level after 4 hrs by luciferase reporter gene assay

Eur J Med Chem 103: 289-301 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.051
BindingDB Entry DOI: 10.7270/Q20C4ZST
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%