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Compile Data Set for Download or QSAR

Found 70 hits from Aristotelian University of Thessaloniki   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50092131
PNG
(1,7-diazonia-15,21-diazapentacyclo[20.6.2.27,14.08...)
Show SMILES C1CCN[c+]2ccn(CCCCCn3cc[c+](NCC1)c1ccccc31)c1ccccc21
Show InChI InChI=1S/C28H34N4/c1-7-17-29-25-15-21-31(27-13-5-3-11-23(25)27)19-9-2-10-20-32-22-16-26(30-18-8-1)24-12-4-6-14-28(24)32/h3-6,11-16,21-22,29-30H,1-2,7-10,17-20H2/q+2
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n/an/a 2n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50061977
PNG
(17,25-diazonia-2,9-diazaheptacyclo[23.6.2.24,7.210...)
Show SMILES C1N[c+]2ccn(Cc3cccc(Cn4cc[c+](NCc5ccc1cc5)c1ccccc41)c3)c1ccccc21
Show InChI InChI=1S/C34H30N4/c1-3-10-33-29(8-1)31-16-18-37(33)23-27-6-5-7-28(20-27)24-38-19-17-32(30-9-2-4-11-34(30)38)36-22-26-14-12-25(13-15-26)21-35-31/h1-20,35-36H,21-24H2/q+2
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n/an/a 3n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Cyclooxygenase-1 (COX-1)


(Homo sapiens (Human))
BDBM13065
PNG
(5-(4-chlorophenyl)-1-(4-methoxyphenyl)-3-(trifluor...)
Show SMILES COc1ccc(cc1)-n1nc(cc1-c1ccc(Cl)cc1)C(F)(F)F
Show InChI InChI=1S/C17H12ClF3N2O/c1-24-14-8-6-13(7-9-14)23-15(10-16(22-23)17(19,20)21)11-2-4-12(18)5-3-11/h2-10H,1H3
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n/an/a 7.80n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of COX1


Eur J Med Chem 46: 191-200 (2010)


Article DOI: 10.1016/j.ejmech.2010.10.035
BindingDB Entry DOI: 10.7270/Q2XD11ZG
More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474856
PNG
(CHEMBL184300)
Show SMILES C1CC[n+]2ccc(NCCCCNc3cc[n+](CC1)c1ccccc31)c1ccccc21
Show InChI InChI=1S/C27H30N4/c1-8-18-30-20-14-24(22-10-2-4-12-26(22)30)28-16-6-7-17-29-25-15-21-31(19-9-1)27-13-5-3-11-23(25)27/h2-5,10-15,20-21H,1,6-9,16-19H2/p+2/b28-24+,29-25+
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n/an/a 9n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474870
PNG
(CHEMBL185146)
Show SMILES C1CCNc2cc[n+](Cc3cccc(C[n+]4ccc(NC1)c1ccccc41)c3)c1ccccc21
Show InChI InChI=1S/C30H28N4/c1-3-12-29-25(10-1)27-14-18-33(29)21-23-8-7-9-24(20-23)22-34-19-15-28(32-17-6-5-16-31-27)26-11-2-4-13-30(26)34/h1-4,7-15,18-20H,5-6,16-17,21-22H2/p+2/b31-27+,32-28?
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n/an/a 10n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474869
PNG
(CHEMBL181911)
Show SMILES C1CCCNc2cc[n+](CCCCC[n+]3ccc(NCC1)c1ccccc31)c1ccccc21
Show InChI InChI=1S/C29H34N4/c1-2-9-19-31-27-17-23-33(29-15-7-5-13-25(27)29)21-11-3-10-20-32-22-16-26(30-18-8-1)24-12-4-6-14-28(24)32/h4-7,12-17,22-23H,1-3,8-11,18-21H2/p+2/b30-26+,31-27?
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n/an/a 12n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474865
PNG
(CHEMBL183644)
Show SMILES C1CCNc2cc[n+](CCCC[n+]3ccc(NCC1)c1ccccc31)c1ccccc21
Show InChI InChI=1S/C27H30N4/c1-6-16-28-24-14-20-30(26-12-4-2-10-22(24)26)18-8-9-19-31-21-15-25(29-17-7-1)23-11-3-5-13-27(23)31/h2-5,10-15,20-21H,1,6-9,16-19H2/p+2/b28-24+,29-25+
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n/an/a 15n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474867
PNG
(CHEMBL184858)
Show SMILES C1CCC[n+]2ccc(NCCCCCNc3cc[n+](CC1)c1ccccc31)c1ccccc21
Show InChI InChI=1S/C29H34N4/c1-2-11-21-33-23-17-27(25-13-5-7-15-29(25)33)31-19-9-3-8-18-30-26-16-22-32(20-10-1)28-14-6-4-12-24(26)28/h4-7,12-17,22-23H,1-3,8-11,18-21H2/p+2/b30-26+,31-27+
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n/an/a 16n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474866
PNG
(CHEMBL181912)
Show SMILES C1CNc2cc[n+](Cc3cccc(C[n+]4ccc(NC1)c1ccccc41)c3)c1ccccc21
Show InChI InChI=1S/C29H26N4/c1-3-11-28-24(9-1)26-13-17-32(28)20-22-7-5-8-23(19-22)21-33-18-14-27(31-16-6-15-30-26)25-10-2-4-12-29(25)33/h1-5,7-14,17-19H,6,15-16,20-21H2/p+2/b30-26+,31-27+
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n/an/a 25n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50473103
PNG
(CHEMBL430146)
Show SMILES C1Nc2cc[n+](Cc3ccc(C[n+]4ccc(NCc5ccc1cc5)c1ccccc41)cc3)c1ccccc21
Show InChI InChI=1S/C34H28N4/c1-3-7-33-29(5-1)31-17-19-37(33)23-27-13-15-28(16-14-27)24-38-20-18-32(30-6-2-4-8-34(30)38)36-22-26-11-9-25(10-12-26)21-35-31/h1-20H,21-24H2/p+2
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n/an/a 28n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474868
PNG
(CHEMBL184891)
Show SMILES C1CC[n+]2ccc(NCCCNc3cc[n+](CC1)c1ccccc31)c1ccccc21
Show InChI InChI=1S/C26H28N4/c1-6-17-29-19-13-23(21-9-2-4-11-25(21)29)27-15-8-16-28-24-14-20-30(18-7-1)26-12-5-3-10-22(24)26/h2-5,9-14,19-20H,1,6-8,15-18H2/p+2/b27-23+,28-24+
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n/an/a 30n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474871
PNG
(CHEMBL182716)
Show SMILES C1CCNc2cc[n+](Cc3cccc(C[n+]4ccc(NCC1)c1ccccc41)c3)c1ccccc21
Show InChI InChI=1S/C31H30N4/c1-6-17-32-28-15-19-34(30-13-4-2-11-26(28)30)22-24-9-8-10-25(21-24)23-35-20-16-29(33-18-7-1)27-12-3-5-14-31(27)35/h2-5,8-16,19-21H,1,6-7,17-18,22-23H2/p+2/b32-28+,33-29+
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n/an/a 31n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474863
PNG
(CHEMBL360624)
Show SMILES C1CCCNc2cc[n+](Cc3cccc(C[n+]4ccc(NCC1)c1ccccc41)c3)c1ccccc21
Show InChI InChI=1S/C32H32N4/c1-2-8-19-34-30-17-21-36(32-15-6-4-13-28(30)32)24-26-11-9-10-25(22-26)23-35-20-16-29(33-18-7-1)27-12-3-5-14-31(27)35/h3-6,9-17,20-22H,1-2,7-8,18-19,23-24H2/p+2/b33-29+,34-30?
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n/an/a 35n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474872
PNG
(CHEMBL1180184)
Show SMILES C1CCNc2cc[n+](CCCC[n+]3ccc(NC1)c1ccccc31)c1ccccc21
Show InChI InChI=1S/C26H28N4/c1-3-11-25-21(9-1)23-13-19-29(25)17-7-8-18-30-20-14-24(28-16-6-5-15-27-23)22-10-2-4-12-26(22)30/h1-4,9-14,19-20H,5-8,15-18H2/p+2/b27-23-,28-24+
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n/an/a 40n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298593
PNG
((R)-2-(2-(7-fluoro-1H-indole-2-carboxamido)benzami...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2cccc(F)c2[nH]1
Show InChI InChI=1/C25H20FN3O4/c26-18-11-6-9-16-14-20(27-22(16)18)24(31)28-19-12-5-4-10-17(19)23(30)29-21(25(32)33)13-15-7-2-1-3-8-15/h1-12,14,21,27H,13H2,(H,28,31)(H,29,30)(H,32,33)/t21-/s2
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n/an/a 55n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50150389
PNG
(17,23-diazonia-2,9-diazahexacyclo[21.6.2.24,7.210,...)
Show SMILES C1CCn2cc[c+](NCc3ccc(CN[c+]4ccn(CC1)c1ccccc41)cc3)c1ccccc21
Show InChI InChI=1S/C31H32N4/c1-6-18-34-20-16-28(26-8-2-4-10-30(26)34)32-22-24-12-14-25(15-13-24)23-33-29-17-21-35(19-7-1)31-11-5-3-9-27(29)31/h2-5,8-17,20-21,32-33H,1,6-7,18-19,22-23H2/q+2
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n/an/a 60n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474858
PNG
(CHEMBL186139)
Show SMILES C1CCCNc2cc[n+](CCCCCC[n+]3ccc(NCC1)c1ccccc31)c1ccccc21
Show InChI InChI=1S/C30H36N4/c1-2-10-20-32-28-18-24-34(30-16-8-6-14-26(28)30)22-12-4-3-11-21-33-23-17-27(31-19-9-1)25-13-5-7-15-29(25)33/h5-8,13-18,23-24H,1-4,9-12,19-22H2/p+2/b31-27+,32-28?
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Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474859
PNG
(CHEMBL185258)
Show SMILES C1CCC[n+]2ccc(NCc3ccc(CNc4cc[n+](CC1)c1ccccc41)cc3)c1ccccc21
Show InChI InChI=1S/C32H32N4/c1-2-8-20-36-22-18-30(28-10-4-6-12-32(28)36)34-24-26-15-13-25(14-16-26)23-33-29-17-21-35(19-7-1)31-11-5-3-9-27(29)31/h3-6,9-18,21-22H,1-2,7-8,19-20,23-24H2/p+2/b33-29+,34-30+
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n/an/a 65n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50473106
PNG
(CHEMBL137175)
Show SMILES C1Nc2cc[n+](Cc3ccc(C[n+]4ccc(NCc5cccc1c5)c1ccccc41)cc3)c1ccccc21
Show InChI InChI=1S/C34H28N4/c1-3-10-33-29(8-1)31-16-18-37(33)23-25-12-14-26(15-13-25)24-38-19-17-32(30-9-2-4-11-34(30)38)36-22-28-7-5-6-27(20-28)21-35-31/h1-20H,21-24H2/p+2/b35-31+,36-32?
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n/an/a 70n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298576
PNG
((R)-2-(2-(1H-indole-2-carboxamido)benzamido)-3-phe...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1
Show InChI InChI=1/C25H21N3O4/c29-23(28-22(25(31)32)14-16-8-2-1-3-9-16)18-11-5-7-13-20(18)27-24(30)21-15-17-10-4-6-12-19(17)26-21/h1-13,15,22,26H,14H2,(H,27,30)(H,28,29)(H,31,32)/t22-/s2
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n/an/a 106n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474857
PNG
(CHEMBL185106)
Show SMILES C1CC[n+]2ccc(NCCCNc3cc[n+](C1)c1ccccc31)c1ccccc21
Show InChI InChI=1S/C25H26N4/c1-3-10-24-20(8-1)22-12-18-28(24)16-5-6-17-29-19-13-23(27-15-7-14-26-22)21-9-2-4-11-25(21)29/h1-4,8-13,18-19H,5-7,14-17H2/p+2/b26-22+,27-23+
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n/an/a 130n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50473107
PNG
(CHEMBL341700)
Show SMILES C1Nc2cc[n+](Cc3cccc(C[n+]4ccc(NCc5cccc1c5)c1ccccc41)c3)c1ccccc21
Show InChI InChI=1S/C34H28N4/c1-3-13-33-29(11-1)31-15-17-37(33)23-27-9-6-10-28(20-27)24-38-18-16-32(30-12-2-4-14-34(30)38)36-22-26-8-5-7-25(19-26)21-35-31/h1-20H,21-24H2/p+2/b35-31-,36-32?
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n/an/a 130n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474862
PNG
(CHEMBL425707)
Show SMILES C1C[n+]2ccc(NCc3ccc(CNc4cc[n+](C1)c1ccccc41)cc3)c1ccccc21
Show InChI InChI=1S/C29H26N4/c1-3-8-28-24(6-1)26-14-18-32(28)16-5-17-33-19-15-27(25-7-2-4-9-29(25)33)31-21-23-12-10-22(11-13-23)20-30-26/h1-4,6-15,18-19H,5,16-17,20-21H2/p+2/b30-26+,31-27+
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n/an/a 150n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474873
PNG
(CHEMBL185137)
Show SMILES C1CC[n+]2ccc(NCc3ccc(CNc4cc[n+](C1)c1ccccc41)cc3)c1ccccc21
Show InChI InChI=1S/C30H28N4/c1-3-9-29-25(7-1)27-15-19-33(29)17-5-6-18-34-20-16-28(26-8-2-4-10-30(26)34)32-22-24-13-11-23(12-14-24)21-31-27/h1-4,7-16,19-20H,5-6,17-18,21-22H2/p+2/b31-27+,32-28+
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n/an/a 150n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298589
PNG
((R)-2-(2-(5-fluoro-1H-indole-2-carboxamido)benzami...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2cc(F)ccc2[nH]1
Show InChI InChI=1/C25H20FN3O4/c26-17-10-11-19-16(13-17)14-21(27-19)24(31)28-20-9-5-4-8-18(20)23(30)29-22(25(32)33)12-15-6-2-1-3-7-15/h1-11,13-14,22,27H,12H2,(H,28,31)(H,29,30)(H,32,33)/t22-/s2
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n/an/a 151n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298592
PNG
((+/-)-2-(2-(7-fluoro-1H-indole-2-carboxamido)benza...)
Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2cccc(F)c2[nH]1
Show InChI InChI=1/C25H20FN3O4/c26-18-11-6-9-16-14-20(27-22(16)18)24(31)28-19-12-5-4-10-17(19)23(30)29-21(25(32)33)13-15-7-2-1-3-8-15/h1-12,14,21,27H,13H2,(H,28,31)(H,29,30)(H,32,33)
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n/an/a 159n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474864
PNG
(CHEMBL119859)
Show SMILES [I-].[I-].C1CCCCNc2cc[n+](CCCCCCCC[n+]3ccc(NCCC1)c1ccccc31)c1ccccc21
Show InChI InChI=1S/C34H44N4.2HI/c1-2-6-14-24-36-32-22-28-38(34-20-12-10-18-30(32)34)26-16-8-4-3-7-15-25-37-27-21-31(35-23-13-5-1)29-17-9-11-19-33(29)37;;/h9-12,17-22,27-28H,1-8,13-16,23-26H2;2*1H/b35-31+,36-32?;;
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n/an/a 190n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50185262
PNG
((+/-)-2-(2-(1H-indole-2-carboxamido)benzamido)-3-p...)
Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1
Show InChI InChI=1/C25H21N3O4/c29-23(28-22(25(31)32)14-16-8-2-1-3-9-16)18-11-5-7-13-20(18)27-24(30)21-15-17-10-4-6-12-19(17)26-21/h1-13,15,22,26H,14H2,(H,27,30)(H,28,29)(H,31,32)
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n/an/a 197n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474861
PNG
(CHEMBL185230)
Show SMILES C1CCCCCNc2cc[n+](CCCCCCCCCC[n+]3ccc(NCCCC1)c1ccccc31)c1ccccc21
Show InChI InChI=1S/C38H52N4/c1-2-6-10-18-28-40-36-26-32-42(38-24-16-14-22-34(36)38)30-20-12-8-4-3-7-11-19-29-41-31-25-35(39-27-17-9-5-1)33-21-13-15-23-37(33)41/h13-16,21-26,31-32H,1-12,17-20,27-30H2/p+2/b39-35+,40-36?
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n/an/a 260n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298591
PNG
((+/-)-2-(2-(6-fluoro-1H-indole-2-carboxamido)benza...)
Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2ccc(F)cc2[nH]1
Show InChI InChI=1/C25H20FN3O4/c26-17-11-10-16-13-21(27-20(16)14-17)24(31)28-19-9-5-4-8-18(19)23(30)29-22(25(32)33)12-15-6-2-1-3-7-15/h1-11,13-14,22,27H,12H2,(H,28,31)(H,29,30)(H,32,33)
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n/an/a 294n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298588
PNG
((+/-)-2-(2-(5-fluoro-1H-indole-2-carboxamido)benza...)
Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2cc(F)ccc2[nH]1
Show InChI InChI=1/C25H20FN3O4/c26-17-10-11-19-16(13-17)14-21(27-19)24(31)28-20-9-5-4-8-18(20)23(30)29-22(25(32)33)12-15-6-2-1-3-7-15/h1-11,13-14,22,27H,12H2,(H,28,31)(H,29,30)(H,32,33)
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n/an/a 314n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298579
PNG
((+/-)-2-(2-(1-methyl-1H-indole-2-carboxamido)benza...)
Show SMILES Cn1c(cc2ccccc12)C(=O)Nc1ccccc1C(=O)NC(Cc1ccccc1)C(O)=O
Show InChI InChI=1/C26H23N3O4/c1-29-22-14-8-5-11-18(22)16-23(29)25(31)27-20-13-7-6-12-19(20)24(30)28-21(26(32)33)15-17-9-3-2-4-10-17/h2-14,16,21H,15H2,1H3,(H,27,31)(H,28,30)(H,32,33)
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n/an/a 350n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474860
PNG
(CHEMBL185006)
Show SMILES C1CNc2cc[n+](CCC[n+]3ccc(NC1)c1ccccc31)c1ccccc21
Show InChI InChI=1S/C24H24N4/c1-3-9-23-19(7-1)21-11-17-27(23)15-6-16-28-18-12-22(26-14-5-13-25-21)20-8-2-4-10-24(20)28/h1-4,7-12,17-18H,5-6,13-16H2/p+2/b25-21+,26-22+
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n/an/a 380n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298583
PNG
((+/-)-3-phenyl-2-(2-(7-(trifluoromethyl)-1H-indole...)
Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2cccc(c2[nH]1)C(F)(F)F
Show InChI InChI=1/C26H20F3N3O4/c27-26(28,29)18-11-6-9-16-14-20(30-22(16)18)24(34)31-19-12-5-4-10-17(19)23(33)32-21(25(35)36)13-15-7-2-1-3-8-15/h1-12,14,21,30H,13H2,(H,31,34)(H,32,33)(H,35,36)
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n/an/a 538n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50474860
PNG
(CHEMBL185006)
Show SMILES C1CNc2cc[n+](CCC[n+]3ccc(NC1)c1ccccc31)c1ccccc21
Show InChI InChI=1S/C24H24N4/c1-3-9-23-19(7-1)21-11-17-27(23)15-6-16-28-18-12-22(26-14-5-13-25-21)20-8-2-4-10-24(20)28/h1-4,7-12,17-18H,5-6,13-16H2/p+2/b25-21+,26-22+
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n/an/a 630n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298582
PNG
((+/-)-2-(2-(7-methyl-1H-indole-2-carboxamido)benza...)
Show SMILES Cc1cccc2cc([nH]c12)C(=O)Nc1ccccc1C(=O)NC(Cc1ccccc1)C(O)=O
Show InChI InChI=1/C26H23N3O4/c1-16-8-7-11-18-15-21(27-23(16)18)25(31)28-20-13-6-5-12-19(20)24(30)29-22(26(32)33)14-17-9-3-2-4-10-17/h2-13,15,22,27H,14H2,1H3,(H,28,31)(H,29,30)(H,32,33)
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n/an/a 671n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298595
PNG
((+/-)-2-(2-(benzofuran-2-carboxamido)benzamido)-3-...)
Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2ccccc2o1
Show InChI InChI=1/C25H20N2O5/c28-23(27-20(25(30)31)14-16-8-2-1-3-9-16)18-11-5-6-12-19(18)26-24(29)22-15-17-10-4-7-13-21(17)32-22/h1-13,15,20H,14H2,(H,26,29)(H,27,28)(H,30,31)
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n/an/a 891n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Small conductance calcium-activated potassium channel


(Rattus norvegicus-RAT-Rattus norvegicus (Rat))
BDBM50048403
PNG
(1,1'-(Deca-4,6-diyne-1,10-diyl)bis(4-amino-2-methy...)
Show SMILES Cc1cc(=[NH2+])c2ccccc2n1CCCCCCCCCCn1c(C)cc(=[NH2+])c2ccccc12
Show InChI InChI=1S/C30H38N4/c1-23-21-27(31)25-15-9-11-17-29(25)33(23)19-13-7-5-3-4-6-8-14-20-34-24(2)22-28(32)26-16-10-12-18-30(26)34/h9-12,15-18,21-22,31-32H,3-8,13-14,19-20H2,1-2H3/p+2
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n/an/a 900n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of after hyperpolarization (AHP) of cultured rat sympathetic neurons as SKCa channel blocking activity


Bioorg Med Chem Lett 14: 4231-5 (2004)

More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298587
PNG
((+/-)-2-(2-(4-fluoro-1H-indole-2-carboxamido)benza...)
Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2c(F)cccc2[nH]1
Show InChI InChI=1/C25H20FN3O4/c26-18-10-6-12-20-17(18)14-21(27-20)24(31)28-19-11-5-4-9-16(19)23(30)29-22(25(32)33)13-15-7-2-1-3-8-15/h1-12,14,22,27H,13H2,(H,28,31)(H,29,30)(H,32,33)
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n/an/a 937n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298586
PNG
((+/-)-2-(2-(1-methyl-5-nitro-1H-indole-2-carboxami...)
Show SMILES Cn1c(cc2cc(ccc12)[N+]([O-])=O)C(=O)Nc1ccccc1C(=O)NC(Cc1ccccc1)C(O)=O
Show InChI InChI=1/C26H22N4O6/c1-29-22-12-11-18(30(35)36)14-17(22)15-23(29)25(32)27-20-10-6-5-9-19(20)24(31)28-21(26(33)34)13-16-7-3-2-4-8-16/h2-12,14-15,21H,13H2,1H3,(H,27,32)(H,28,31)(H,33,34)
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n/an/a 1.11E+3n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298596
PNG
((+/-)-2-(2-(benzo[b]thiophene-2-carboxamido)benzam...)
Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2ccccc2s1
Show InChI InChI=1/C25H20N2O4S/c28-23(27-20(25(30)31)14-16-8-2-1-3-9-16)18-11-5-6-12-19(18)26-24(29)22-15-17-10-4-7-13-21(17)32-22/h1-13,15,20H,14H2,(H,26,29)(H,27,28)(H,30,31)
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n/an/a 1.12E+3n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298572
PNG
((+/-)-3-phenyl-2-(2-(4,5,6,7-tetrahydro-1H-indole-...)
Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2CCCCc2[nH]1
Show InChI InChI=1/C25H25N3O4/c29-23(28-22(25(31)32)14-16-8-2-1-3-9-16)18-11-5-7-13-20(18)27-24(30)21-15-17-10-4-6-12-19(17)26-21/h1-3,5,7-9,11,13,15,22,26H,4,6,10,12,14H2,(H,27,30)(H,28,29)(H,31,32)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM32020
PNG
(4-[4-(3,4-dihydroxyphenyl)-2,3-dimethyl-butyl]pyro...)
Show SMILES CC(Cc1ccc(O)c(O)c1)C(C)Cc1ccc(O)c(O)c1
Show InChI InChI=1S/C18H22O4/c1-11(7-13-3-5-15(19)17(21)9-13)12(2)8-14-4-6-16(20)18(22)10-14/h3-6,9-12,19-22H,7-8H2,1-2H3
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n/an/a 1.30E+3n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Inhibition of soybean lipoxygenase after 7 mins


Bioorg Med Chem 15: 951-61 (2006)


Article DOI: 10.1016/j.bmc.2006.10.056
BindingDB Entry DOI: 10.7270/Q2CN73JN
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298584
PNG
((+/-)-2-(2-(5-chloro-1H-indole-2-carboxamido)benza...)
Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1/C25H20ClN3O4/c26-17-10-11-19-16(13-17)14-21(27-19)24(31)28-20-9-5-4-8-18(20)23(30)29-22(25(32)33)12-15-6-2-1-3-7-15/h1-11,13-14,22,27H,12H2,(H,28,31)(H,29,30)(H,32,33)
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n/an/a 1.84E+3n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298577
PNG
((+/-)-2-(2-(1H-indole-3-carboxamido)benzamido)-3-p...)
Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1c[nH]c2ccccc12
Show InChI InChI=1/C25H21N3O4/c29-23(28-22(25(31)32)14-16-8-2-1-3-9-16)18-11-5-7-13-21(18)27-24(30)19-15-26-20-12-6-4-10-17(19)20/h1-13,15,22,26H,14H2,(H,27,30)(H,28,29)(H,31,32)
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n/an/a 1.87E+3n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298581
PNG
((+/-)-2-(2-(3-methyl-1H-indole-2-carboxamido)benza...)
Show SMILES Cc1c([nH]c2ccccc12)C(=O)Nc1ccccc1C(=O)NC(Cc1ccccc1)C(O)=O
Show InChI InChI=1/C26H23N3O4/c1-16-18-11-5-7-13-20(18)27-23(16)25(31)28-21-14-8-6-12-19(21)24(30)29-22(26(32)33)15-17-9-3-2-4-10-17/h2-14,22,27H,15H2,1H3,(H,28,31)(H,29,30)(H,32,33)
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n/an/a 2.06E+3n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298599
PNG
((+/-)-2-(2-(1H-indene-2-carboxamido)benzamido)-3-p...)
Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)C1=Cc2ccccc2C1
Show InChI InChI=1/C26H22N2O4/c29-24(20-15-18-10-4-5-11-19(18)16-20)27-22-13-7-6-12-21(22)25(30)28-23(26(31)32)14-17-8-2-1-3-9-17/h1-13,15,23H,14,16H2,(H,27,29)(H,28,30)(H,31,32)
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n/an/a 2.53E+3n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298574
PNG
((+/-)-3-phenyl-2-(2-(thiophene-2-carboxamido)benza...)
Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cccs1
Show InChI InChI=1/C21H18N2O4S/c24-19(23-17(21(26)27)13-14-7-2-1-3-8-14)15-9-4-5-10-16(15)22-20(25)18-11-6-12-28-18/h1-12,17H,13H2,(H,22,25)(H,23,24)(H,26,27)
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n/an/a 2.56E+3n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298580
PNG
((+/-)-2-(2-(5-methyl-1H-indole-2-carboxamido)benza...)
Show SMILES Cc1ccc2[nH]c(cc2c1)C(=O)Nc1ccccc1C(=O)NC(Cc1ccccc1)C(O)=O
Show InChI InChI=1/C26H23N3O4/c1-16-11-12-20-18(13-16)15-22(27-20)25(31)28-21-10-6-5-9-19(21)24(30)29-23(26(32)33)14-17-7-3-2-4-8-17/h2-13,15,23,27H,14H2,1H3,(H,28,31)(H,29,30)(H,32,33)
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n/an/a 2.79E+3n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50298600
PNG
((+/-)-3-phenyl-2-(2-(quinoline-3-carboxamido)benza...)
Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cnc2ccccc2c1
Show InChI InChI=1/C26H21N3O4/c30-24(19-15-18-10-4-6-12-21(18)27-16-19)28-22-13-7-5-11-20(22)25(31)29-23(26(32)33)14-17-8-2-1-3-9-17/h1-13,15-16,23H,14H2,(H,28,30)(H,29,31)(H,32,33)
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n/an/a 3.13E+3n/an/an/an/an/an/a



Aristotelian University of Thessaloniki

Curated by ChEMBL


Assay Description
Displacement of [125I]-CCK8 from CCK1 receptor in rat pancreatic acinar cells


Bioorg Med Chem 17: 5198-206 (2009)


Article DOI: 10.1016/j.bmc.2009.05.067
BindingDB Entry DOI: 10.7270/Q2QC03JB
More data for this
Ligand-Target Pair
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