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Compile Data Set for Download or QSAR

Found 42 hits Enz. Inhib. hit(s) with all data for entry = 50029502   
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
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285009
PNG
(3-{3-[(3R,5R)-1-(tert-Butylcarbamoyl-methyl)-5-cyc...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(O)=O)C(=O)N(CC(=O)NC(C)(C)C)c2c1)C1CCCCC1
Show InChI InChI=1S/C31H40N4O5/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(33-30(40)32-22-12-8-11-21(16-22)29(38)39)28(37)35(26(23)15-19)18-27(36)34-31(2,3)4/h8,11-16,20,24-25H,5-7,9-10,17-18H2,1-4H3,(H,34,36)(H,38,39)(H2,32,33,40)/t24-,25-/m1/s1
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n/an/a 0.100n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285009
PNG
(3-{3-[(3R,5R)-1-(tert-Butylcarbamoyl-methyl)-5-cyc...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(O)=O)C(=O)N(CC(=O)NC(C)(C)C)c2c1)C1CCCCC1
Show InChI InChI=1S/C31H40N4O5/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(33-30(40)32-22-12-8-11-21(16-22)29(38)39)28(37)35(26(23)15-19)18-27(36)34-31(2,3)4/h8,11-16,20,24-25H,5-7,9-10,17-18H2,1-4H3,(H,34,36)(H,38,39)(H2,32,33,40)/t24-,25-/m1/s1
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n/an/a 0.100n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285019
PNG
(CHEMBL294161 | N-tert-Butyl-2-((3R,5R)-5-cyclohexy...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)-c3nnn[nH]3)C(=O)N(CC(=O)NC(C)(C)C)c2c1)C1CCCCC1
Show InChI InChI=1S/C31H40N8O3/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(29(41)39(26(23)15-19)18-27(40)34-31(2,3)4)33-30(42)32-22-12-8-11-21(16-22)28-35-37-38-36-28/h8,11-16,20,24-25H,5-7,9-10,17-18H2,1-4H3,(H,34,40)(H2,32,33,42)(H,35,36,37,38)/t24-,25-/m1/s1
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n/an/a 0.220n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285011
PNG
(CHEMBL294252 | N-tert-Butyl-2-{(3R,5R)-5-cyclohexy...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(=O)NS(C)(=O)=O)C(=O)N(CC(=O)NC(C)(C)C)c2c1)C1CCCCC1
Show InChI InChI=1S/C32H43N5O6S/c1-20-14-15-24-25(21-10-7-6-8-11-21)18-26(30(40)37(27(24)16-20)19-28(38)35-32(2,3)4)34-31(41)33-23-13-9-12-22(17-23)29(39)36-44(5,42)43/h9,12-17,21,25-26H,6-8,10-11,18-19H2,1-5H3,(H,35,38)(H,36,39)(H2,33,34,41)/t25-,26-/m1/s1
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n/an/a 0.260n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50037849
PNG
(CHEMBL291458 | N-tert-Butyl-2-{(3R,5R)-3-[3-(3-chl...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(Cl)c3)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C30H33ClN4O3/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(33-29(38)32-22-12-8-11-21(31)16-22)28(37)35(26(23)15-19)18-27(36)34-30(2,3)4/h5-16,24-25H,17-18H2,1-4H3,(H,34,36)(H2,32,33,38)/t24-,25-/m1/s1
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n/an/a 0.480n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285014
PNG
(3-{3-[(3R,5R)-1-(tert-Butylcarbamoyl-methyl)-5-cyc...)
Show SMILES COC(=O)c1cccc(NC(=O)N[C@@H]2C[C@H](C3CCCCC3)c3ccc(C)cc3N(CC(=O)NC(C)(C)C)C2=O)c1
Show InChI InChI=1S/C32H42N4O5/c1-20-14-15-24-25(21-10-7-6-8-11-21)18-26(29(38)36(27(24)16-20)19-28(37)35-32(2,3)4)34-31(40)33-23-13-9-12-22(17-23)30(39)41-5/h9,12-17,21,25-26H,6-8,10-11,18-19H2,1-5H3,(H,35,37)(H2,33,34,40)/t25-,26-/m1/s1
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n/an/a 0.600n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285010
PNG
(3-{3-[(3R,5R)-1-(tert-Butylcarbamoyl-methyl)-8-met...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(=O)Nc3nnn[nH]3)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C32H35N9O4/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(29(44)41(26(23)15-19)18-27(42)36-32(2,3)4)34-31(45)33-22-12-8-11-21(16-22)28(43)35-30-37-39-40-38-30/h5-16,24-25H,17-18H2,1-4H3,(H,36,42)(H2,33,34,45)(H2,35,37,38,39,40,43)/t24-,25-/m1/s1
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n/an/a 0.700n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285012
PNG
(CHEMBL301418 | N-tert-Butyl-2-((3R,5R)-8-methyl-2-...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)-c3nnn[nH]3)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C31H34N8O3/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(29(41)39(26(23)15-19)18-27(40)34-31(2,3)4)33-30(42)32-22-12-8-11-21(16-22)28-35-37-38-36-28/h5-16,24-25H,17-18H2,1-4H3,(H,34,40)(H2,32,33,42)(H,35,36,37,38)/t24-,25-/m1/s1
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n/an/a 0.810n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285018
PNG
(CHEMBL59234 | N-tert-Butyl-2-((3R,5S)-5-cyclohexyl...)
Show SMILES Cc1ccc2[C@@H](CC3CCCCC3)C[C@@H](NC(=O)Nc3cccc(c3)-c3nnn[nH]3)C(=O)N(CC(=O)NC(C)(C)C)c2c1
Show InChI InChI=1S/C32H42N8O3/c1-20-13-14-25-23(16-21-9-6-5-7-10-21)18-26(30(42)40(27(25)15-20)19-28(41)35-32(2,3)4)34-31(43)33-24-12-8-11-22(17-24)29-36-38-39-37-29/h8,11-15,17,21,23,26H,5-7,9-10,16,18-19H2,1-4H3,(H,35,41)(H2,33,34,43)(H,36,37,38,39)/t23-,26+/m0/s1
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n/an/a 0.880n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285022
PNG
(CHEMBL57642 | N-tert-Butyl-2-{(3R,5R)-3-[3-(3-meth...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(=O)NS(C)(=O)=O)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C32H37N5O6S/c1-20-14-15-24-25(21-10-7-6-8-11-21)18-26(30(40)37(27(24)16-20)19-28(38)35-32(2,3)4)34-31(41)33-23-13-9-12-22(17-23)29(39)36-44(5,42)43/h6-17,25-26H,18-19H2,1-5H3,(H,35,38)(H,36,39)(H2,33,34,41)/t25-,26-/m1/s1
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n/an/a 0.880n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285020
PNG
(CHEMBL292856 | N-tert-Butyl-2-((3R,5R)-5-isopropyl...)
Show SMILES CC(C)[C@H]1C[C@@H](NC(=O)Nc2cccc(c2)-c2nnn[nH]2)C(=O)N(CC(=O)NC(C)(C)C)c2cc(C)ccc12
Show InChI InChI=1S/C28H36N8O3/c1-16(2)21-14-22(30-27(39)29-19-9-7-8-18(13-19)25-32-34-35-33-25)26(38)36(15-24(37)31-28(4,5)6)23-12-17(3)10-11-20(21)23/h7-13,16,21-22H,14-15H2,1-6H3,(H,31,37)(H2,29,30,39)(H,32,33,34,35)/t21-,22-/m1/s1
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n/an/a 0.980n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285005
PNG
(CHEMBL293490 | N-tert-Butyl-2-{(3R,5R)-3-[3-(3-eth...)
Show SMILES CCS(=O)(=O)NC(=O)c1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccc(C)cc3N(CC(=O)NC(C)(C)C)C2=O)c1
Show InChI InChI=1S/C33H39N5O6S/c1-6-45(43,44)37-30(40)23-13-10-14-24(18-23)34-32(42)35-27-19-26(22-11-8-7-9-12-22)25-16-15-21(2)17-28(25)38(31(27)41)20-29(39)36-33(3,4)5/h7-18,26-27H,6,19-20H2,1-5H3,(H,36,39)(H,37,40)(H2,34,35,42)/t26-,27-/m1/s1
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n/an/a 1n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285021
PNG
(3-{3-[(3R,5R)-1-(tert-Butylcarbamoyl-methyl)-8-met...)
Show SMILES COC(=O)c1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccc(C)cc3N(CC(=O)NC(C)(C)C)C2=O)c1
Show InChI InChI=1S/C32H36N4O5/c1-20-14-15-24-25(21-10-7-6-8-11-21)18-26(29(38)36(27(24)16-20)19-28(37)35-32(2,3)4)34-31(40)33-23-13-9-12-22(17-23)30(39)41-5/h6-17,25-26H,18-19H2,1-5H3,(H,35,37)(H2,33,34,40)/t25-,26-/m1/s1
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n/an/a 1.40n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285013
PNG
(2-((3R,5S)-5-Benzyl-8-methyl-2-oxo-3-{3-[3-(1H-tet...)
Show SMILES Cc1ccc2[C@@H](Cc3ccccc3)C[C@@H](NC(=O)Nc3cccc(c3)-c3nnn[nH]3)C(=O)N(CC(=O)NC(C)(C)C)c2c1
Show InChI InChI=1S/C32H36N8O3/c1-20-13-14-25-23(16-21-9-6-5-7-10-21)18-26(30(42)40(27(25)15-20)19-28(41)35-32(2,3)4)34-31(43)33-24-12-8-11-22(17-24)29-36-38-39-37-29/h5-15,17,23,26H,16,18-19H2,1-4H3,(H,35,41)(H2,33,34,43)(H,36,37,38,39)/t23-,26+/m0/s1
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n/an/a 1.70n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285007
PNG
(3-{3-[(3R,5R)-1-(tert-Butylcarbamoyl-methyl)-8-met...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(O)=O)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C31H34N4O5/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(33-30(40)32-22-12-8-11-21(16-22)29(38)39)28(37)35(26(23)15-19)18-27(36)34-31(2,3)4/h5-16,24-25H,17-18H2,1-4H3,(H,34,36)(H,38,39)(H2,32,33,40)/t24-,25-/m1/s1
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n/an/a 2.70n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285015
PNG
(CHEMBL408392 | N-tert-Butyl-2-{(3R,5R)-8-methyl-2-...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(=O)NS(=O)(=O)Cc3ccccc3)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C38H41N5O6S/c1-25-18-19-30-31(27-14-9-6-10-15-27)22-32(36(46)43(33(30)20-25)23-34(44)41-38(2,3)4)40-37(47)39-29-17-11-16-28(21-29)35(45)42-50(48,49)24-26-12-7-5-8-13-26/h5-21,31-32H,22-24H2,1-4H3,(H,41,44)(H,42,45)(H2,39,40,47)/t31-,32-/m1/s1
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n/an/a 4.20n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285017
PNG
(2-{(3R,5R)-3-[3-(3-Benzenesulfonylaminocarbonyl-ph...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(=O)NS(=O)(=O)c3ccccc3)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C37H39N5O6S/c1-24-18-19-29-30(25-12-7-5-8-13-25)22-31(35(45)42(32(29)20-24)23-33(43)40-37(2,3)4)39-36(46)38-27-15-11-14-26(21-27)34(44)41-49(47,48)28-16-9-6-10-17-28/h5-21,30-31H,22-23H2,1-4H3,(H,40,43)(H,41,44)(H2,38,39,46)/t30-,31-/m1/s1
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n/an/a 4.80n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285008
PNG
(CHEMBL408490 | N-tert-Butyl-2-{(3R,5R)-8-methyl-2-...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(=O)NS(=O)(=O)C(F)(F)F)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C32H34F3N5O6S/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(29(43)40(26(23)15-19)18-27(41)38-31(2,3)4)37-30(44)36-22-12-8-11-21(16-22)28(42)39-47(45,46)32(33,34)35/h5-16,24-25H,17-18H2,1-4H3,(H,38,41)(H,39,42)(H2,36,37,44)/t24-,25-/m1/s1
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n/an/a 5.10n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285006
PNG
(CHEMBL58154 | N-tert-Butyl-2-((3R,5R)-8-methyl-2-o...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(=O)NS(=O)(=O)c3ccccc3C)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C38H41N5O6S/c1-24-18-19-29-30(26-13-7-6-8-14-26)22-31(36(46)43(32(29)20-24)23-34(44)41-38(3,4)5)40-37(47)39-28-16-11-15-27(21-28)35(45)42-50(48,49)33-17-10-9-12-25(33)2/h6-21,30-31H,22-23H2,1-5H3,(H,41,44)(H,42,45)(H2,39,40,47)/t30-,31-/m1/s1
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n/an/a 7.90n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50006878
PNG
((R)-1-(1-Methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benz...)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2ccc(C)cc2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C24H22N4O2/c1-16-12-14-18(15-13-16)25-24(30)27-22-23(29)28(2)20-11-7-6-10-19(20)21(26-22)17-8-4-3-5-9-17/h3-15,22H,1-2H3,(H2,25,27,30)/t22-/m0/s1
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n/an/a 8.10n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50285016
PNG
(CHEMBL293107 | N-tert-Butyl-2-((3R,5R)-8-methyl-2-...)
Show SMILES Cc1ccc(cc1)[C@H]1C[C@@H](NC(=O)Nc2cccc(c2)-c2nnn[nH]2)C(=O)N(CC(=O)NC(C)(C)C)c2cc(C)ccc12
Show InChI InChI=1S/C32H36N8O3/c1-19-9-12-21(13-10-19)25-17-26(34-31(43)33-23-8-6-7-22(16-23)29-36-38-39-37-29)30(42)40(18-28(41)35-32(3,4)5)27-15-20(2)11-14-24(25)27/h6-16,25-26H,17-18H2,1-5H3,(H,35,41)(H2,33,34,43)(H,36,37,38,39)/t25-,26-/m1/s1
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n/an/a 9n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285013
PNG
(2-((3R,5S)-5-Benzyl-8-methyl-2-oxo-3-{3-[3-(1H-tet...)
Show SMILES Cc1ccc2[C@@H](Cc3ccccc3)C[C@@H](NC(=O)Nc3cccc(c3)-c3nnn[nH]3)C(=O)N(CC(=O)NC(C)(C)C)c2c1
Show InChI InChI=1S/C32H36N8O3/c1-20-13-14-25-23(16-21-9-6-5-7-10-21)18-26(30(42)40(27(25)15-20)19-28(41)35-32(2,3)4)34-31(43)33-24-12-8-11-22(17-24)29-36-38-39-37-29/h5-15,17,23,26H,16,18-19H2,1-4H3,(H,35,41)(H2,33,34,43)(H,36,37,38,39)/t23-,26+/m0/s1
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n/an/a 34n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50006878
PNG
((R)-1-(1-Methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benz...)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2ccc(C)cc2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C24H22N4O2/c1-16-12-14-18(15-13-16)25-24(30)27-22-23(29)28(2)20-11-7-6-10-19(20)21(26-22)17-8-4-3-5-9-17/h3-15,22H,1-2H3,(H2,25,27,30)/t22-/m0/s1
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n/an/a 86n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50037849
PNG
(CHEMBL291458 | N-tert-Butyl-2-{(3R,5R)-3-[3-(3-chl...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(Cl)c3)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C30H33ClN4O3/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(33-29(38)32-22-12-8-11-21(31)16-22)28(37)35(26(23)15-19)18-27(36)34-30(2,3)4/h5-16,24-25H,17-18H2,1-4H3,(H,34,36)(H2,32,33,38)/t24-,25-/m1/s1
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n/an/a 180n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285018
PNG
(CHEMBL59234 | N-tert-Butyl-2-((3R,5S)-5-cyclohexyl...)
Show SMILES Cc1ccc2[C@@H](CC3CCCCC3)C[C@@H](NC(=O)Nc3cccc(c3)-c3nnn[nH]3)C(=O)N(CC(=O)NC(C)(C)C)c2c1
Show InChI InChI=1S/C32H42N8O3/c1-20-13-14-25-23(16-21-9-6-5-7-10-21)18-26(30(42)40(27(25)15-20)19-28(41)35-32(2,3)4)34-31(43)33-24-12-8-11-22(17-24)29-36-38-39-37-29/h8,11-15,17,21,23,26H,5-7,9-10,16,18-19H2,1-4H3,(H,35,41)(H2,33,34,43)(H,36,37,38,39)/t23-,26+/m0/s1
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n/an/a 220n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285020
PNG
(CHEMBL292856 | N-tert-Butyl-2-((3R,5R)-5-isopropyl...)
Show SMILES CC(C)[C@H]1C[C@@H](NC(=O)Nc2cccc(c2)-c2nnn[nH]2)C(=O)N(CC(=O)NC(C)(C)C)c2cc(C)ccc12
Show InChI InChI=1S/C28H36N8O3/c1-16(2)21-14-22(30-27(39)29-19-9-7-8-18(13-19)25-32-34-35-33-25)26(38)36(15-24(37)31-28(4,5)6)23-12-17(3)10-11-20(21)23/h7-13,16,21-22H,14-15H2,1-6H3,(H,31,37)(H2,29,30,39)(H,32,33,34,35)/t21-,22-/m1/s1
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n/an/a 250n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285021
PNG
(3-{3-[(3R,5R)-1-(tert-Butylcarbamoyl-methyl)-8-met...)
Show SMILES COC(=O)c1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccc(C)cc3N(CC(=O)NC(C)(C)C)C2=O)c1
Show InChI InChI=1S/C32H36N4O5/c1-20-14-15-24-25(21-10-7-6-8-11-21)18-26(29(38)36(27(24)16-20)19-28(37)35-32(2,3)4)34-31(40)33-23-13-9-12-22(17-23)30(39)41-5/h6-17,25-26H,18-19H2,1-5H3,(H,35,37)(H2,33,34,40)/t25-,26-/m1/s1
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n/an/a 310n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285008
PNG
(CHEMBL408490 | N-tert-Butyl-2-{(3R,5R)-8-methyl-2-...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(=O)NS(=O)(=O)C(F)(F)F)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C32H34F3N5O6S/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(29(43)40(26(23)15-19)18-27(41)38-31(2,3)4)37-30(44)36-22-12-8-11-21(16-22)28(42)39-47(45,46)32(33,34)35/h5-16,24-25H,17-18H2,1-4H3,(H,38,41)(H,39,42)(H2,36,37,44)/t24-,25-/m1/s1
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n/an/a 320n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285014
PNG
(3-{3-[(3R,5R)-1-(tert-Butylcarbamoyl-methyl)-5-cyc...)
Show SMILES COC(=O)c1cccc(NC(=O)N[C@@H]2C[C@H](C3CCCCC3)c3ccc(C)cc3N(CC(=O)NC(C)(C)C)C2=O)c1
Show InChI InChI=1S/C32H42N4O5/c1-20-14-15-24-25(21-10-7-6-8-11-21)18-26(29(38)36(27(24)16-20)19-28(37)35-32(2,3)4)34-31(40)33-23-13-9-12-22(17-23)30(39)41-5/h9,12-17,21,25-26H,6-8,10-11,18-19H2,1-5H3,(H,35,37)(H2,33,34,40)/t25-,26-/m1/s1
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n/an/a 370n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285019
PNG
(CHEMBL294161 | N-tert-Butyl-2-((3R,5R)-5-cyclohexy...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)-c3nnn[nH]3)C(=O)N(CC(=O)NC(C)(C)C)c2c1)C1CCCCC1
Show InChI InChI=1S/C31H40N8O3/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(29(41)39(26(23)15-19)18-27(40)34-31(2,3)4)33-30(42)32-22-12-8-11-21(16-22)28-35-37-38-36-28/h8,11-16,20,24-25H,5-7,9-10,17-18H2,1-4H3,(H,34,40)(H2,32,33,42)(H,35,36,37,38)/t24-,25-/m1/s1
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n/an/a 490n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285011
PNG
(CHEMBL294252 | N-tert-Butyl-2-{(3R,5R)-5-cyclohexy...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(=O)NS(C)(=O)=O)C(=O)N(CC(=O)NC(C)(C)C)c2c1)C1CCCCC1
Show InChI InChI=1S/C32H43N5O6S/c1-20-14-15-24-25(21-10-7-6-8-11-21)18-26(30(40)37(27(24)16-20)19-28(38)35-32(2,3)4)34-31(41)33-23-13-9-12-22(17-23)29(39)36-44(5,42)43/h9,12-17,21,25-26H,6-8,10-11,18-19H2,1-5H3,(H,35,38)(H,36,39)(H2,33,34,41)/t25-,26-/m1/s1
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n/an/a 520n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285016
PNG
(CHEMBL293107 | N-tert-Butyl-2-((3R,5R)-8-methyl-2-...)
Show SMILES Cc1ccc(cc1)[C@H]1C[C@@H](NC(=O)Nc2cccc(c2)-c2nnn[nH]2)C(=O)N(CC(=O)NC(C)(C)C)c2cc(C)ccc12
Show InChI InChI=1S/C32H36N8O3/c1-19-9-12-21(13-10-19)25-17-26(34-31(43)33-23-8-6-7-22(16-23)29-36-38-39-37-29)30(42)40(18-28(41)35-32(3,4)5)27-15-20(2)11-14-24(25)27/h6-16,25-26H,17-18H2,1-5H3,(H,35,41)(H2,33,34,43)(H,36,37,38,39)/t25-,26-/m1/s1
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n/an/a 600n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285012
PNG
(CHEMBL301418 | N-tert-Butyl-2-((3R,5R)-8-methyl-2-...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)-c3nnn[nH]3)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C31H34N8O3/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(29(41)39(26(23)15-19)18-27(40)34-31(2,3)4)33-30(42)32-22-12-8-11-21(16-22)28-35-37-38-36-28/h5-16,24-25H,17-18H2,1-4H3,(H,34,40)(H2,32,33,42)(H,35,36,37,38)/t24-,25-/m1/s1
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n/an/a 620n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285015
PNG
(CHEMBL408392 | N-tert-Butyl-2-{(3R,5R)-8-methyl-2-...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(=O)NS(=O)(=O)Cc3ccccc3)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C38H41N5O6S/c1-25-18-19-30-31(27-14-9-6-10-15-27)22-32(36(46)43(33(30)20-25)23-34(44)41-38(2,3)4)40-37(47)39-29-17-11-16-28(21-29)35(45)42-50(48,49)24-26-12-7-5-8-13-26/h5-21,31-32H,22-24H2,1-4H3,(H,41,44)(H,42,45)(H2,39,40,47)/t31-,32-/m1/s1
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n/an/a 730n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285022
PNG
(CHEMBL57642 | N-tert-Butyl-2-{(3R,5R)-3-[3-(3-meth...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(=O)NS(C)(=O)=O)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C32H37N5O6S/c1-20-14-15-24-25(21-10-7-6-8-11-21)18-26(30(40)37(27(24)16-20)19-28(38)35-32(2,3)4)34-31(41)33-23-13-9-12-22(17-23)29(39)36-44(5,42)43/h6-17,25-26H,18-19H2,1-5H3,(H,35,38)(H,36,39)(H2,33,34,41)/t25-,26-/m1/s1
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n/an/a 970n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285010
PNG
(3-{3-[(3R,5R)-1-(tert-Butylcarbamoyl-methyl)-8-met...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(=O)Nc3nnn[nH]3)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C32H35N9O4/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(29(44)41(26(23)15-19)18-27(42)36-32(2,3)4)34-31(45)33-22-12-8-11-21(16-22)28(43)35-30-37-39-40-38-30/h5-16,24-25H,17-18H2,1-4H3,(H,36,42)(H2,33,34,45)(H2,35,37,38,39,40,43)/t24-,25-/m1/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285005
PNG
(CHEMBL293490 | N-tert-Butyl-2-{(3R,5R)-3-[3-(3-eth...)
Show SMILES CCS(=O)(=O)NC(=O)c1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccc(C)cc3N(CC(=O)NC(C)(C)C)C2=O)c1
Show InChI InChI=1S/C33H39N5O6S/c1-6-45(43,44)37-30(40)23-13-10-14-24(18-23)34-32(42)35-27-19-26(22-11-8-7-9-12-22)25-16-15-21(2)17-28(25)38(31(27)41)20-29(39)36-33(3,4)5/h7-18,26-27H,6,19-20H2,1-5H3,(H,36,39)(H,37,40)(H2,34,35,42)/t26-,27-/m1/s1
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n/an/a 1.10E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285006
PNG
(CHEMBL58154 | N-tert-Butyl-2-((3R,5R)-8-methyl-2-o...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(=O)NS(=O)(=O)c3ccccc3C)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C38H41N5O6S/c1-24-18-19-29-30(26-13-7-6-8-14-26)22-31(36(46)43(32(29)20-24)23-34(44)41-38(3,4)5)40-37(47)39-28-16-11-15-27(21-28)35(45)42-50(48,49)33-17-10-9-12-25(33)2/h6-21,30-31H,22-23H2,1-5H3,(H,41,44)(H,42,45)(H2,39,40,47)/t30-,31-/m1/s1
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n/an/a 1.30E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285017
PNG
(2-{(3R,5R)-3-[3-(3-Benzenesulfonylaminocarbonyl-ph...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(=O)NS(=O)(=O)c3ccccc3)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C37H39N5O6S/c1-24-18-19-29-30(25-12-7-5-8-13-25)22-31(35(45)42(32(29)20-24)23-33(43)40-37(2,3)4)39-36(46)38-27-15-11-14-26(21-27)34(44)41-49(47,48)28-16-9-6-10-17-28/h5-21,30-31H,22-23H2,1-4H3,(H,40,43)(H,41,44)(H2,38,39,46)/t30-,31-/m1/s1
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n/an/a 1.30E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285009
PNG
(3-{3-[(3R,5R)-1-(tert-Butylcarbamoyl-methyl)-5-cyc...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(O)=O)C(=O)N(CC(=O)NC(C)(C)C)c2c1)C1CCCCC1
Show InChI InChI=1S/C31H40N4O5/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(33-30(40)32-22-12-8-11-21(16-22)29(38)39)28(37)35(26(23)15-19)18-27(36)34-31(2,3)4/h8,11-16,20,24-25H,5-7,9-10,17-18H2,1-4H3,(H,34,36)(H,38,39)(H2,32,33,40)/t24-,25-/m1/s1
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n/an/a 1.40E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested for its ability to displace [I-125]-glucagon from the glucagon receptor


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285009
PNG
(3-{3-[(3R,5R)-1-(tert-Butylcarbamoyl-methyl)-5-cyc...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(O)=O)C(=O)N(CC(=O)NC(C)(C)C)c2c1)C1CCCCC1
Show InChI InChI=1S/C31H40N4O5/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(33-30(40)32-22-12-8-11-21(16-22)29(38)39)28(37)35(26(23)15-19)18-27(36)34-31(2,3)4/h8,11-16,20,24-25H,5-7,9-10,17-18H2,1-4H3,(H,34,36)(H,38,39)(H2,32,33,40)/t24-,25-/m1/s1
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n/an/a 1.40E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-B (CCK-B) receptor in guinea pig cortex


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(Cavia porcellus)
BDBM50285007
PNG
(3-{3-[(3R,5R)-1-(tert-Butylcarbamoyl-methyl)-8-met...)
Show SMILES Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(O)=O)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c1ccccc1
Show InChI InChI=1S/C31H34N4O5/c1-19-13-14-23-24(20-9-6-5-7-10-20)17-25(33-30(40)32-22-12-8-11-21(16-22)29(38)39)28(37)35(26(23)15-19)18-27(36)34-31(2,3)4/h5-16,24-25H,17-18H2,1-4H3,(H,34,36)(H,38,39)(H2,32,33,40)/t24-,25-/m1/s1
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n/an/a 4.20E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding activity towards cholecystokinin-A (CCK-A) receptor in guinea pig pancreas


Bioorg Med Chem Lett 5: 1933-1936 (1995)


Article DOI: 10.1016/0960-894X(95)00327-P
BindingDB Entry DOI: 10.7270/Q22Z15H2
More data for this
Ligand-Target Pair