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17 similar compounds to monomer 50040671

Compile data set for download or QSAR
Wt: 419.5
BDBM82514
Wt: 419.5
BDBM50040664
Wt: 419.5
BDBM50040665
Wt: 445.5
BDBM50040667
Wt: 445.5
BDBM50040668
Wt: 391.4
BDBM50040669
Wt: 405.4
BDBM50040672
Wt: 445.5
BDBM50059319
Wt: 476.6
BDBM50286112
Wt: 506.5
BDBM50286114
Wt: 420.5
BDBM50286116
Wt: 406.4
BDBM50286117
Wt: 448.5
BDBM50286118
Wt: 462.5
BDBM50286119
Wt: 502.5
BDBM50286120
Displayed 1 to 15 (of 17 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 38 hits for monomerid = 82514,50040664,50040665,50040667,50040668,50040669,50040672,50059319,50286112,50286114,50286116,50286117,50286118,50286119,50286120   
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
Cholecystokinin B


(GUINEA PIG)
BDBM82514
PNG
(1-[[(3R)-2,3-Dihydro-1-methyl-2-oxo-5-[(hexahydro-...)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2cccc(C)c2)C1=O)N1CCCCCC1
Show InChI InChI=1S/C24H29N5O2/c1-17-10-9-11-18(16-17)25-24(31)27-21-23(30)28(2)20-13-6-5-12-19(20)22(26-21)29-14-7-3-4-8-15-29/h5-6,9-13,16,21H,3-4,7-8,14-15H2,1-2H3,(H2,25,27,31)/t21-/m0/s1
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1.20n/an/an/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by PDSP Ki Database




Mol Pharmacol 46: 943-8 (1994)


BindingDB Entry DOI: 10.7270/Q2QR4VMN
More data for this
Ligand-Target Pair
CCKBR


(RAT)
BDBM82514
PNG
(1-[[(3R)-2,3-Dihydro-1-methyl-2-oxo-5-[(hexahydro-...)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2cccc(C)c2)C1=O)N1CCCCCC1
Show InChI InChI=1S/C24H29N5O2/c1-17-10-9-11-18(16-17)25-24(31)27-21-23(30)28(2)20-13-6-5-12-19(20)22(26-21)29-14-7-3-4-8-15-29/h5-6,9-13,16,21H,3-4,7-8,14-15H2,1-2H3,(H2,25,27,31)/t21-/m0/s1
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3.20E+3n/an/an/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by PDSP Ki Database




Mol Pharmacol 46: 943-8 (1994)


BindingDB Entry DOI: 10.7270/Q2QR4VMN
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50059319
PNG
(1-[(R)-5-(3-Aza-bicyclo[3.2.2]non-3-yl)-1-methyl-2...)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2cccc(C)c2)C1=O)N1CC2CCC(CC2)C1
Show InChI InChI=1S/C26H31N5O2/c1-17-6-5-7-20(14-17)27-26(33)29-23-25(32)30(2)22-9-4-3-8-21(22)24(28-23)31-15-18-10-11-19(16-31)13-12-18/h3-9,14,18-19,23H,10-13,15-16H2,1-2H3,(H2,27,29,33)/t18?,19?,23-/m0/s1
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n/an/a 1.60E+3n/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ligand binding to Cholecystokinin type A receptor receptor from rat pancreatic tissue.


J Med Chem 40: 2491-501 (1997)


Article DOI: 10.1021/jm9608523
BindingDB Entry DOI: 10.7270/Q2F47N84
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50040664
PNG
(1-(5-Azepan-1-yl-1-methyl-2-oxo-2,3-dihydro-1H-ben...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCCCCC1
Show InChI InChI=1S/C24H29N5O2/c1-17-10-9-11-18(16-17)25-24(31)27-21-23(30)28(2)20-13-6-5-12-19(20)22(26-21)29-14-7-3-4-8-15-29/h5-6,9-13,16,21H,3-4,7-8,14-15H2,1-2H3,(H2,25,27,31)
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n/an/a 10n/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ligand binding to Cholecystokinin type A receptor receptor from rat pancreatic tissue.


J Med Chem 40: 2491-501 (1997)


Article DOI: 10.1021/jm9608523
BindingDB Entry DOI: 10.7270/Q2F47N84
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50040669
PNG
(1-(1-Methyl-2-oxo-5-pyrrolidin-1-yl-2,3-dihydro-1H...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCCC1
Show InChI InChI=1S/C22H25N5O2/c1-15-8-7-9-16(14-15)23-22(29)25-19-21(28)26(2)18-11-4-3-10-17(18)20(24-19)27-12-5-6-13-27/h3-4,7-11,14,19H,5-6,12-13H2,1-2H3,(H2,23,25,29)
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n/an/a 480n/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ligand binding to Cholecystokinin type A receptor receptor from rat pancreatic tissue.


J Med Chem 40: 2491-501 (1997)


Article DOI: 10.1021/jm9608523
BindingDB Entry DOI: 10.7270/Q2F47N84
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50040664
PNG
(1-(5-Azepan-1-yl-1-methyl-2-oxo-2,3-dihydro-1H-ben...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCCCCC1
Show InChI InChI=1S/C24H29N5O2/c1-17-10-9-11-18(16-17)25-24(31)27-21-23(30)28(2)20-13-6-5-12-19(20)22(26-21)29-14-7-3-4-8-15-29/h5-6,9-13,16,21H,3-4,7-8,14-15H2,1-2H3,(H2,25,27,31)
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n/an/a 1.30n/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ligand binding to Cholecystokinin type B receptor from guinea pig cortical membrane.


J Med Chem 40: 2491-501 (1997)


Article DOI: 10.1021/jm9608523
BindingDB Entry DOI: 10.7270/Q2F47N84
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50286112
PNG
(1-[5-(4-Methyl-piperazin-1-yl)-2-oxo-1-propyl-2,3-...)
Show SMILES CCCN1c2ccccc2C(=NC(NC(=O)Nc2cccc(CCC)c2)C1=O)N1CCN(C)CC1
Show InChI InChI=1S/C27H36N6O2/c1-4-9-20-10-8-11-21(19-20)28-27(35)30-24-26(34)33(14-5-2)23-13-7-6-12-22(23)25(29-24)32-17-15-31(3)16-18-32/h6-8,10-13,19,24H,4-5,9,14-18H2,1-3H3,(H2,28,30,35)
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n/an/a 18n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type B receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50286112
PNG
(1-[5-(4-Methyl-piperazin-1-yl)-2-oxo-1-propyl-2,3-...)
Show SMILES CCCN1c2ccccc2C(=NC(NC(=O)Nc2cccc(CCC)c2)C1=O)N1CCN(C)CC1
Show InChI InChI=1S/C27H36N6O2/c1-4-9-20-10-8-11-21(19-20)28-27(35)30-24-26(34)33(14-5-2)23-13-7-6-12-22(23)25(29-24)32-17-15-31(3)16-18-32/h6-8,10-13,19,24H,4-5,9,14-18H2,1-3H3,(H2,28,30,35)
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n/an/a 5.31E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type A receptor in rat pancreas


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50286114
PNG
(4-[1-Methyl-2-oxo-3-(3-m-tolyl-ureido)-2,3-dihydro...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCN(CC1)C(=O)OC(C)(C)C
Show InChI InChI=1S/C27H34N6O4/c1-18-9-8-10-19(17-18)28-25(35)30-22-24(34)31(5)21-12-7-6-11-20(21)23(29-22)32-13-15-33(16-14-32)26(36)37-27(2,3)4/h6-12,17,22H,13-16H2,1-5H3,(H2,28,30,35)
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n/an/a>3.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type B receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50286116
PNG
(1-[1-Methyl-5-(4-methyl-piperazin-1-yl)-2-oxo-2,3-...)
Show SMILES CN1CCN(CC1)C1=NC(NC(=O)Nc2cccc(C)c2)C(=O)N(C)c2ccccc12
Show InChI InChI=1S/C23H28N6O2/c1-16-7-6-8-17(15-16)24-23(31)26-20-22(30)28(3)19-10-5-4-9-18(19)21(25-20)29-13-11-27(2)12-14-29/h4-10,15,20H,11-14H2,1-3H3,(H2,24,26,31)
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n/an/a 121n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type B receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50286117
PNG
(1-(1-Methyl-2-oxo-5-piperazin-1-yl-2,3-dihydro-1H-...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCNCC1
Show InChI InChI=1S/C22H26N6O2/c1-15-6-5-7-16(14-15)24-22(30)26-19-21(29)27(2)18-9-4-3-8-17(18)20(25-19)28-12-10-23-11-13-28/h3-9,14,19,23H,10-13H2,1-2H3,(H2,24,26,30)
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n/an/a>3.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type A receptor in rat pancreas


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50286118
PNG
(1-[5-(4-Methyl-piperazin-1-yl)-2-oxo-1-propyl-2,3-...)
Show SMILES CCCN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCN(C)CC1
Show InChI InChI=1S/C25H32N6O2/c1-4-12-31-21-11-6-5-10-20(21)23(30-15-13-29(3)14-16-30)27-22(24(31)32)28-25(33)26-19-9-7-8-18(2)17-19/h5-11,17,22H,4,12-16H2,1-3H3,(H2,26,28,33)
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n/an/a 3.20E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type A receptor in rat pancreas


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50059319
PNG
(1-[(R)-5-(3-Aza-bicyclo[3.2.2]non-3-yl)-1-methyl-2...)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2cccc(C)c2)C1=O)N1CC2CCC(CC2)C1
Show InChI InChI=1S/C26H31N5O2/c1-17-6-5-7-20(14-17)27-26(33)29-23-25(32)30(2)22-9-4-3-8-21(22)24(28-23)31-15-18-10-11-19(16-31)13-12-18/h3-9,14,18-19,23H,10-13,15-16H2,1-2H3,(H2,27,29,33)/t18?,19?,23-/m0/s1
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n/an/a 1.60E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type A receptor in rat pancreas


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50286119
PNG
(1-(3-Ethyl-phenyl)-3-[5-(4-methyl-piperazin-1-yl)-...)
Show SMILES CCCN1c2ccccc2C(=NC(NC(=O)Nc2cccc(CC)c2)C1=O)N1CCN(C)CC1
Show InChI InChI=1S/C26H34N6O2/c1-4-13-32-22-12-7-6-11-21(22)24(31-16-14-30(3)15-17-31)28-23(25(32)33)29-26(34)27-20-10-8-9-19(5-2)18-20/h6-12,18,23H,4-5,13-17H2,1-3H3,(H2,27,29,34)
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n/an/a 4.90n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type B receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50286119
PNG
(1-(3-Ethyl-phenyl)-3-[5-(4-methyl-piperazin-1-yl)-...)
Show SMILES CCCN1c2ccccc2C(=NC(NC(=O)Nc2cccc(CC)c2)C1=O)N1CCN(C)CC1
Show InChI InChI=1S/C26H34N6O2/c1-4-13-32-22-12-7-6-11-21(22)24(31-16-14-30(3)15-17-31)28-23(25(32)33)29-26(34)27-20-10-8-9-19(5-2)18-20/h6-12,18,23H,4-5,13-17H2,1-3H3,(H2,27,29,34)
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n/an/a>3.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type A receptor in rat pancreas


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50286118
PNG
(1-[5-(4-Methyl-piperazin-1-yl)-2-oxo-1-propyl-2,3-...)
Show SMILES CCCN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCN(C)CC1
Show InChI InChI=1S/C25H32N6O2/c1-4-12-31-21-11-6-5-10-20(21)23(30-15-13-29(3)14-16-30)27-22(24(31)32)28-25(33)26-19-9-7-8-18(2)17-19/h5-11,17,22H,4,12-16H2,1-3H3,(H2,26,28,33)
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n/an/a 9.80n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type B receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50040669
PNG
(1-(1-Methyl-2-oxo-5-pyrrolidin-1-yl-2,3-dihydro-1H...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCCC1
Show InChI InChI=1S/C22H25N5O2/c1-15-8-7-9-16(14-15)23-22(29)25-19-21(28)26(2)18-11-4-3-10-17(18)20(24-19)27-12-5-6-13-27/h3-4,7-11,14,19H,5-6,12-13H2,1-2H3,(H2,23,25,29)
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n/an/a 480n/an/an/an/an/an/a



Merck, Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against Cholecystokinin type A receptor from rat pancreas using [125]BH CCK-8s as radioligand.


J Med Chem 37: 719-21 (1994)


Article DOI: 10.1021/jm00032a002
BindingDB Entry DOI: 10.7270/Q2QN67FP
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50286120
PNG
(1-[5-(4-Methyl-piperazin-1-yl)-2-oxo-1-propyl-2,3-...)
Show SMILES CCCN1c2ccccc2C(=NC(NC(=O)Nc2cccc(c2)C(F)(F)F)C1=O)N1CCN(C)CC1
Show InChI InChI=1S/C25H29F3N6O2/c1-3-11-34-20-10-5-4-9-19(20)22(33-14-12-32(2)13-15-33)30-21(23(34)35)31-24(36)29-18-8-6-7-17(16-18)25(26,27)28/h4-10,16,21H,3,11-15H2,1-2H3,(H2,29,31,36)
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n/an/a 12n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type B receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50059319
PNG
(1-[(R)-5-(3-Aza-bicyclo[3.2.2]non-3-yl)-1-methyl-2...)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2cccc(C)c2)C1=O)N1CC2CCC(CC2)C1
Show InChI InChI=1S/C26H31N5O2/c1-17-6-5-7-20(14-17)27-26(33)29-23-25(32)30(2)22-9-4-3-8-21(22)24(28-23)31-15-18-10-11-19(16-31)13-12-18/h3-9,14,18-19,23H,10-13,15-16H2,1-2H3,(H2,27,29,33)/t18?,19?,23-/m0/s1
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n/an/a 0.100n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type B receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50286114
PNG
(4-[1-Methyl-2-oxo-3-(3-m-tolyl-ureido)-2,3-dihydro...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCN(CC1)C(=O)OC(C)(C)C
Show InChI InChI=1S/C27H34N6O4/c1-18-9-8-10-19(17-18)28-25(35)30-22-24(34)31(5)21-12-7-6-11-20(21)23(29-22)32-13-15-33(16-14-32)26(36)37-27(2,3)4/h6-12,17,22H,13-16H2,1-5H3,(H2,28,30,35)
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n/an/a>3.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type A receptor in rat pancreas


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50286116
PNG
(1-[1-Methyl-5-(4-methyl-piperazin-1-yl)-2-oxo-2,3-...)
Show SMILES CN1CCN(CC1)C1=NC(NC(=O)Nc2cccc(C)c2)C(=O)N(C)c2ccccc12
Show InChI InChI=1S/C23H28N6O2/c1-16-7-6-8-17(15-16)24-23(31)26-20-22(30)28(3)19-10-5-4-9-18(19)21(25-20)29-13-11-27(2)12-14-29/h4-10,15,20H,11-14H2,1-3H3,(H2,24,26,31)
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n/an/a 4.26E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type A receptor in rat pancreas


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50286120
PNG
(1-[5-(4-Methyl-piperazin-1-yl)-2-oxo-1-propyl-2,3-...)
Show SMILES CCCN1c2ccccc2C(=NC(NC(=O)Nc2cccc(c2)C(F)(F)F)C1=O)N1CCN(C)CC1
Show InChI InChI=1S/C25H29F3N6O2/c1-3-11-34-20-10-5-4-9-19(20)22(33-14-12-32(2)13-15-33)30-21(23(34)35)31-24(36)29-18-8-6-7-17(16-18)25(26,27)28/h4-10,16,21H,3,11-15H2,1-2H3,(H2,29,31,36)
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n/an/a 3.80E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type A receptor in rat pancreas


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50040664
PNG
(1-(5-Azepan-1-yl-1-methyl-2-oxo-2,3-dihydro-1H-ben...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCCCCC1
Show InChI InChI=1S/C24H29N5O2/c1-17-10-9-11-18(16-17)25-24(31)27-21-23(30)28(2)20-13-6-5-12-19(20)22(26-21)29-14-7-3-4-8-15-29/h5-6,9-13,16,21H,3-4,7-8,14-15H2,1-2H3,(H2,25,27,31)
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n/an/a 10n/an/an/an/an/an/a



Merck, Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against Cholecystokinin type A receptor from rat pancreas using [125]BH CCK-8s as radioligand.


J Med Chem 37: 719-21 (1994)


Article DOI: 10.1021/jm00032a002
BindingDB Entry DOI: 10.7270/Q2QN67FP
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50040665
PNG
(1-((S)-5-Azepan-1-yl-1-methyl-2-oxo-2,3-dihydro-1H...)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)Nc2cccc(C)c2)C1=O)N1CCCCCC1
Show InChI InChI=1S/C24H29N5O2/c1-17-10-9-11-18(16-17)25-24(31)27-21-23(30)28(2)20-13-6-5-12-19(20)22(26-21)29-14-7-3-4-8-15-29/h5-6,9-13,16,21H,3-4,7-8,14-15H2,1-2H3,(H2,25,27,31)/t21-/m1/s1
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n/an/a 7.90n/an/an/an/an/an/a



Merck, Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against Cholecystokinin type A receptor from rat pancreas using [125]BH CCK-8s as radioligand.


J Med Chem 37: 719-21 (1994)


Article DOI: 10.1021/jm00032a002
BindingDB Entry DOI: 10.7270/Q2QN67FP
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50040667
PNG
(1-[(R)-5-(3-Aza-bicyclo[3.2.2]non-3-yl)-1-methyl-2...)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2cccc(C)c2)C1=O)N1CC2CCC(CC2)C1
Show InChI InChI=1S/C26H31N5O2/c1-17-6-5-7-20(14-17)27-26(33)29-23-25(32)30(2)22-9-4-3-8-21(22)24(28-23)31-15-18-10-11-19(16-31)13-12-18/h3-9,14,18-19,23H,10-13,15-16H2,1-2H3,(H2,27,29,33)/t18?,19?,23-/m0/s1
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n/an/a 1.60E+3n/an/an/an/an/an/a



Merck, Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against Cholecystokinin type A receptor from rat pancreas using [125]BH CCK-8s as radioligand.


J Med Chem 37: 719-21 (1994)


Article DOI: 10.1021/jm00032a002
BindingDB Entry DOI: 10.7270/Q2QN67FP
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50040668
PNG
(1-[(S)-5-(3-Aza-bicyclo[3.2.2]non-3-yl)-1-methyl-2...)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)Nc2cccc(C)c2)C1=O)N1CC2CCC(CC2)C1
Show InChI InChI=1S/C26H31N5O2/c1-17-6-5-7-20(14-17)27-26(33)29-23-25(32)30(2)22-9-4-3-8-21(22)24(28-23)31-15-18-10-11-19(16-31)13-12-18/h3-9,14,18-19,23H,10-13,15-16H2,1-2H3,(H2,27,29,33)/t18?,19?,23-/m1/s1
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n/an/a 6.5n/an/an/an/an/an/a



Merck, Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against Cholecystokinin type A receptor from rat pancreas using [125]BH CCK-8s as radioligand.


J Med Chem 37: 719-21 (1994)


Article DOI: 10.1021/jm00032a002
BindingDB Entry DOI: 10.7270/Q2QN67FP
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50040665
PNG
(1-((S)-5-Azepan-1-yl-1-methyl-2-oxo-2,3-dihydro-1H...)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)Nc2cccc(C)c2)C1=O)N1CCCCCC1
Show InChI InChI=1S/C24H29N5O2/c1-17-10-9-11-18(16-17)25-24(31)27-21-23(30)28(2)20-13-6-5-12-19(20)22(26-21)29-14-7-3-4-8-15-29/h5-6,9-13,16,21H,3-4,7-8,14-15H2,1-2H3,(H2,25,27,31)/t21-/m1/s1
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n/an/a 144n/an/an/an/an/an/a



Merck, Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against Cholecystokinin type B receptor from guinea pig cortex using [125]BH CCK-8s as radioligand.


J Med Chem 37: 719-21 (1994)


Article DOI: 10.1021/jm00032a002
BindingDB Entry DOI: 10.7270/Q2QN67FP
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50040669
PNG
(1-(1-Methyl-2-oxo-5-pyrrolidin-1-yl-2,3-dihydro-1H...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCCC1
Show InChI InChI=1S/C22H25N5O2/c1-15-8-7-9-16(14-15)23-22(29)25-19-21(28)26(2)18-11-4-3-10-17(18)20(24-19)27-12-5-6-13-27/h3-4,7-11,14,19H,5-6,12-13H2,1-2H3,(H2,23,25,29)
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n/an/a 137n/an/an/an/an/an/a



Merck, Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against Cholecystokinin type B receptor from guinea pig cortex using [125]BH CCK-8s as radioligand.


J Med Chem 37: 719-21 (1994)


Article DOI: 10.1021/jm00032a002
BindingDB Entry DOI: 10.7270/Q2QN67FP
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50040668
PNG
(1-[(S)-5-(3-Aza-bicyclo[3.2.2]non-3-yl)-1-methyl-2...)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)Nc2cccc(C)c2)C1=O)N1CC2CCC(CC2)C1
Show InChI InChI=1S/C26H31N5O2/c1-17-6-5-7-20(14-17)27-26(33)29-23-25(32)30(2)22-9-4-3-8-21(22)24(28-23)31-15-18-10-11-19(16-31)13-12-18/h3-9,14,18-19,23H,10-13,15-16H2,1-2H3,(H2,27,29,33)/t18?,19?,23-/m1/s1
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n/an/a 27n/an/an/an/an/an/a



Merck, Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against Cholecystokinin type B receptor from guinea pig cortex using [125]BH CCK-8s as radioligand.


J Med Chem 37: 719-21 (1994)


Article DOI: 10.1021/jm00032a002
BindingDB Entry DOI: 10.7270/Q2QN67FP
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM82514
PNG
(1-[[(3R)-2,3-Dihydro-1-methyl-2-oxo-5-[(hexahydro-...)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2cccc(C)c2)C1=O)N1CCCCCC1
Show InChI InChI=1S/C24H29N5O2/c1-17-10-9-11-18(16-17)25-24(31)27-21-23(30)28(2)20-13-6-5-12-19(20)22(26-21)29-14-7-3-4-8-15-29/h5-6,9-13,16,21H,3-4,7-8,14-15H2,1-2H3,(H2,25,27,31)/t21-/m0/s1
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n/an/a 1.40n/an/an/an/an/an/a



Merck, Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against Cholecystokinin type B receptor from guinea pig cortex using [125]BH CCK-8s as radioligand.


J Med Chem 37: 719-21 (1994)


Article DOI: 10.1021/jm00032a002
BindingDB Entry DOI: 10.7270/Q2QN67FP
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM82514
PNG
(1-[[(3R)-2,3-Dihydro-1-methyl-2-oxo-5-[(hexahydro-...)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2cccc(C)c2)C1=O)N1CCCCCC1
Show InChI InChI=1S/C24H29N5O2/c1-17-10-9-11-18(16-17)25-24(31)27-21-23(30)28(2)20-13-6-5-12-19(20)22(26-21)29-14-7-3-4-8-15-29/h5-6,9-13,16,21H,3-4,7-8,14-15H2,1-2H3,(H2,25,27,31)/t21-/m0/s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



Merck, Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against Cholecystokinin type A receptor from rat pancreas using [125]BH CCK-8s as radioligand.


J Med Chem 37: 719-21 (1994)


Article DOI: 10.1021/jm00032a002
BindingDB Entry DOI: 10.7270/Q2QN67FP
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50040664
PNG
(1-(5-Azepan-1-yl-1-methyl-2-oxo-2,3-dihydro-1H-ben...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCCCCC1
Show InChI InChI=1S/C24H29N5O2/c1-17-10-9-11-18(16-17)25-24(31)27-21-23(30)28(2)20-13-6-5-12-19(20)22(26-21)29-14-7-3-4-8-15-29/h5-6,9-13,16,21H,3-4,7-8,14-15H2,1-2H3,(H2,25,27,31)
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n/an/a 1.30n/an/an/an/an/an/a



Merck, Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against Cholecystokinin type B receptor from guinea pig cortex using [125]BH CCK-8s as radioligand.


J Med Chem 37: 719-21 (1994)


Article DOI: 10.1021/jm00032a002
BindingDB Entry DOI: 10.7270/Q2QN67FP
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50040667
PNG
(1-[(R)-5-(3-Aza-bicyclo[3.2.2]non-3-yl)-1-methyl-2...)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2cccc(C)c2)C1=O)N1CC2CCC(CC2)C1
Show InChI InChI=1S/C26H31N5O2/c1-17-6-5-7-20(14-17)27-26(33)29-23-25(32)30(2)22-9-4-3-8-21(22)24(28-23)31-15-18-10-11-19(16-31)13-12-18/h3-9,14,18-19,23H,10-13,15-16H2,1-2H3,(H2,27,29,33)/t18?,19?,23-/m0/s1
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n/an/a 0.100n/an/an/an/an/an/a



Merck, Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against Cholecystokinin type B receptor from guinea pig cortex using [125]BH CCK-8s as radioligand.


J Med Chem 37: 719-21 (1994)


Article DOI: 10.1021/jm00032a002
BindingDB Entry DOI: 10.7270/Q2QN67FP
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50040672
PNG
(1-(1-Methyl-2-oxo-5-piperidin-1-yl-2,3-dihydro-1H-...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCCCC1
Show InChI InChI=1S/C23H27N5O2/c1-16-9-8-10-17(15-16)24-23(30)26-20-22(29)27(2)19-12-5-4-11-18(19)21(25-20)28-13-6-3-7-14-28/h4-5,8-12,15,20H,3,6-7,13-14H2,1-2H3,(H2,24,26,30)
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n/an/a 5.70n/an/an/an/an/an/a



Merck, Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against Cholecystokinin type B receptor from guinea pig cortex using [125]BH CCK-8s as radioligand.


J Med Chem 37: 719-21 (1994)


Article DOI: 10.1021/jm00032a002
BindingDB Entry DOI: 10.7270/Q2QN67FP
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50040672
PNG
(1-(1-Methyl-2-oxo-5-piperidin-1-yl-2,3-dihydro-1H-...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCCCC1
Show InChI InChI=1S/C23H27N5O2/c1-16-9-8-10-17(15-16)24-23(30)26-20-22(29)27(2)19-12-5-4-11-18(19)21(25-20)28-13-6-3-7-14-28/h4-5,8-12,15,20H,3,6-7,13-14H2,1-2H3,(H2,24,26,30)
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n/an/a 17n/an/an/an/an/an/a



Merck, Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against Cholecystokinin type A receptor from rat pancreas using [125]BH CCK-8s as radioligand.


J Med Chem 37: 719-21 (1994)


Article DOI: 10.1021/jm00032a002
BindingDB Entry DOI: 10.7270/Q2QN67FP
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50059319
PNG
(1-[(R)-5-(3-Aza-bicyclo[3.2.2]non-3-yl)-1-methyl-2...)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2cccc(C)c2)C1=O)N1CC2CCC(CC2)C1
Show InChI InChI=1S/C26H31N5O2/c1-17-6-5-7-20(14-17)27-26(33)29-23-25(32)30(2)22-9-4-3-8-21(22)24(28-23)31-15-18-10-11-19(16-31)13-12-18/h3-9,14,18-19,23H,10-13,15-16H2,1-2H3,(H2,27,29,33)/t18?,19?,23-/m0/s1
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n/an/a 0.100n/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ligand binding to Cholecystokinin type B receptor from guinea pig cortical membrane.


J Med Chem 40: 2491-501 (1997)


Article DOI: 10.1021/jm9608523
BindingDB Entry DOI: 10.7270/Q2F47N84
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50040669
PNG
(1-(1-Methyl-2-oxo-5-pyrrolidin-1-yl-2,3-dihydro-1H...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCCC1
Show InChI InChI=1S/C22H25N5O2/c1-15-8-7-9-16(14-15)23-22(29)25-19-21(28)26(2)18-11-4-3-10-17(18)20(24-19)27-12-5-6-13-27/h3-4,7-11,14,19H,5-6,12-13H2,1-2H3,(H2,23,25,29)
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PubMed
n/an/a 137n/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ligand binding to Cholecystokinin type B receptor from guinea pig cortical membrane.


J Med Chem 40: 2491-501 (1997)


Article DOI: 10.1021/jm9608523
BindingDB Entry DOI: 10.7270/Q2F47N84
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50286117
PNG
(1-(1-Methyl-2-oxo-5-piperazin-1-yl-2,3-dihydro-1H-...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)N1CCNCC1
Show InChI InChI=1S/C22H26N6O2/c1-15-6-5-7-16(14-15)24-22(30)26-19-21(29)27(2)18-9-4-3-8-17(18)20(25-19)28-12-10-23-11-13-28/h3-9,14,19,23H,10-13H2,1-2H3,(H2,24,26,30)
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n/an/a 880n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-BH CCK-8S from Cholecystokinin type B receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 3023-3026 (1995)


Article DOI: 10.1016/0960-894X(95)00530-0
BindingDB Entry DOI: 10.7270/Q2VX0GGR
More data for this
Ligand-Target Pair