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PubMed code 2909725

Compile data set for download or QSAR
Found 42 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Cholecystokinin receptor type A


(RAT)		BDBM50005463
PNG
((R)-1H-Indole-2-carboxylic acid (1-methyl-2-oxo-5-...)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)c2cc3ccccc3[nH]2)C1=O)c1ccccc1 |r,c:9|
Show InChI InChI=1S/C25H20N4O2/c1-29-21-14-8-6-12-18(21)22(16-9-3-2-4-10-16)27-23(25(29)31)28-24(30)20-15-17-11-5-7-13-19(17)26-20/h2-15,23,26H,1H3,(H,28,30)/t23-/m1/s1
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n/an/a 0.0800n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50020270
PNG
((RS)-1-(4-Chloro-phenyl)-3-[2-oxo-1-(2-oxo-2-pyrro...)
Show SMILES Clc1ccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)N3CCCC3)C2=O)cc1 |t:10|
Show InChI InChI=1S/C28H26ClN5O3/c29-20-12-14-21(15-13-20)30-28(37)32-26-27(36)34(18-24(35)33-16-6-7-17-33)23-11-5-4-10-22(23)25(31-26)19-8-2-1-3-9-19/h1-5,8-15,26H,6-7,16-18H2,(H2,30,32,37)
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n/an/a 0.280n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)		BDBM50367623
PNG
(CHEMBL1907852)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)c2ccc(Cl)cc2)C1=O)c1ccccc1F |r,c:9|
Show InChI InChI=1S/C23H17ClFN3O2/c1-28-19-9-5-3-7-17(19)20(16-6-2-4-8-18(16)25)26-21(23(28)30)27-22(29)14-10-12-15(24)13-11-14/h2-13,21H,1H3,(H,27,29)/t21-/m1/s1
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n/an/a 0.390n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50020270
PNG
((RS)-1-(4-Chloro-phenyl)-3-[2-oxo-1-(2-oxo-2-pyrro...)
Show SMILES Clc1ccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)N3CCCC3)C2=O)cc1 |t:10|
Show InChI InChI=1S/C28H26ClN5O3/c29-20-12-14-21(15-13-20)30-28(37)32-26-27(36)34(18-24(35)33-16-6-7-17-33)23-11-5-4-10-22(23)25(31-26)19-8-2-1-3-9-19/h1-5,8-15,26H,6-7,16-18H2,(H2,30,32,37)
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n/an/a 0.5n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of 125 I-gastrin from gastrin receptor of guinea pig gastric glands

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50020269
PNG
((RS)-{3-[3-(4-Chloro-phenyl)-ureido]-2-oxo-5-pheny...)
Show SMILES CCOC(=O)CN1c2ccccc2C(=NC(NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1 |c:14|
Show InChI InChI=1S/C26H23ClN4O4/c1-2-35-22(32)16-31-21-11-7-6-10-20(21)23(17-8-4-3-5-9-17)29-24(25(31)33)30-26(34)28-19-14-12-18(27)13-15-19/h3-15,24H,2,16H2,1H3,(H2,28,30,34)
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n/an/a 1n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM81962
PNG
(S-L-365,260)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2cccc(C)c2)C1=O)c1ccccc1 |r,c:9|
Show InChI InChI=1S/C24H22N4O2/c1-16-9-8-12-18(15-16)25-24(30)27-22-23(29)28(2)20-14-7-6-13-19(20)21(26-22)17-10-4-3-5-11-17/h3-15,22H,1-2H3,(H2,25,27,30)/t22-/m0/s1
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n/an/a 1.10n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of 125 I-gastrin from gastrin receptor of guinea pig gastric glands

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50020271
PNG
((RS)-[3-[3-(4-Chloro-phenyl)-ureido]-5-(2-fluoro-p...)
Show SMILES CCOC(=O)CN1c2ccccc2C(=NC(NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1F |c:14|
Show InChI InChI=1S/C26H22ClFN4O4/c1-2-36-22(33)15-32-21-10-6-4-8-19(21)23(18-7-3-5-9-20(18)28)30-24(25(32)34)31-26(35)29-17-13-11-16(27)12-14-17/h3-14,24H,2,15H2,1H3,(H2,29,31,35)
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n/an/a 1.20n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM81962
PNG
(S-L-365,260)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2cccc(C)c2)C1=O)c1ccccc1 |r,c:9|
Show InChI InChI=1S/C24H22N4O2/c1-16-9-8-12-18(15-16)25-24(30)27-22-23(29)28(2)20-14-7-6-13-19(20)21(26-22)17-10-4-3-5-11-17/h3-15,22H,1-2H3,(H2,25,27,30)/t22-/m0/s1
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n/an/a 2n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)		BDBM50452491
PNG
(CHEMBL2092868)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)c2ccc(Cl)cc2)C1=O)c1ccccc1F |r,c:9|
Show InChI InChI=1S/C23H17ClFN3O2/c1-28-19-9-5-3-7-17(19)20(16-6-2-4-8-18(16)25)26-21(23(28)30)27-22(29)14-10-12-15(24)13-11-14/h2-13,21H,1H3,(H,27,29)/t21-/m0/s1
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n/an/a 2.90n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)		BDBM50061220
PNG
(1-((S)-1-Methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benz...)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)Nc2cccc(C)c2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C24H22N4O2/c1-16-9-8-12-18(15-16)25-24(30)27-22-23(29)28(2)20-14-7-6-13-19(20)21(26-22)17-10-4-3-5-11-17/h3-15,22H,1-2H3,(H2,25,27,30)/t22-/m1/s1
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n/an/a 3n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50452555
PNG
(CHEMBL289498)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C24H22N4O2/c1-16-9-8-12-18(15-16)25-24(30)27-22-23(29)28(2)20-14-7-6-13-19(20)21(26-22)17-10-4-3-5-11-17/h3-15,22H,1-2H3,(H2,25,27,30)
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n/an/a 3.10n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of 125 I-gastrin from gastrin receptor of guinea pig gastric glands

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50020269
PNG
((RS)-{3-[3-(4-Chloro-phenyl)-ureido]-2-oxo-5-pheny...)
Show SMILES CCOC(=O)CN1c2ccccc2C(=NC(NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1 |c:14|
Show InChI InChI=1S/C26H23ClN4O4/c1-2-35-22(32)16-31-21-11-7-6-10-20(21)23(17-8-4-3-5-9-17)29-24(25(31)33)30-26(34)28-19-14-12-18(27)13-15-19/h3-15,24H,2,16H2,1H3,(H2,28,30,34)
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n/an/a 3.30n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of 125 I-gastrin from gastrin receptor of guinea pig gastric glands

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50020271
PNG
((RS)-[3-[3-(4-Chloro-phenyl)-ureido]-5-(2-fluoro-p...)
Show SMILES CCOC(=O)CN1c2ccccc2C(=NC(NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1F |c:14|
Show InChI InChI=1S/C26H22ClFN4O4/c1-2-36-22(33)15-32-21-10-6-4-8-19(21)23(18-7-3-5-9-20(18)28)30-24(25(32)34)31-26(35)29-17-13-11-16(27)12-14-17/h3-14,24H,2,15H2,1H3,(H2,29,31,35)
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n/an/a 4.10n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of 125 I-gastrin from gastrin receptor of guinea pig gastric glands

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50281711
PNG
(1-(4-Chloro-phenyl)-3-((R)-1-methyl-2-oxo-5-phenyl...)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C23H19ClN4O2/c1-28-19-10-6-5-9-18(19)20(15-7-3-2-4-8-15)26-21(22(28)29)27-23(30)25-17-13-11-16(24)12-14-17/h2-14,21H,1H3,(H2,25,27,30)/t21-/m0/s1
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n/an/a 5.5n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of 125 I-gastrin from gastrin receptor of guinea pig gastric glands

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50452555
PNG
(CHEMBL289498)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C24H22N4O2/c1-16-9-8-12-18(15-16)25-24(30)27-22-23(29)28(2)20-14-7-6-13-19(20)21(26-22)17-10-4-3-5-11-17/h3-15,22H,1-2H3,(H2,25,27,30)
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n/an/a 7.10n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)		BDBM50452555
PNG
(CHEMBL289498)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2cccc(C)c2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C24H22N4O2/c1-16-9-8-12-18(15-16)25-24(30)27-22-23(29)28(2)20-14-7-6-13-19(20)21(26-22)17-10-4-3-5-11-17/h3-15,22H,1-2H3,(H2,25,27,30)
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n/an/a 8.10n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50281711
PNG
(1-(4-Chloro-phenyl)-3-((R)-1-methyl-2-oxo-5-phenyl...)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C23H19ClN4O2/c1-28-19-10-6-5-9-18(19)20(15-7-3-2-4-8-15)26-21(22(28)29)27-23(30)25-17-13-11-16(24)12-14-17/h2-14,21H,1H3,(H2,25,27,30)/t21-/m0/s1
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n/an/a 12n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of 125 I-gastrin from gastrin receptor of guinea pig gastric glands

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50020268
PNG
((R)-1-(4-Chloro-phenyl)-3-(1-methyl-2-oxo-5-phenyl...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C23H19ClN4O2/c1-28-19-10-6-5-9-18(19)20(15-7-3-2-4-8-15)26-21(22(28)29)27-23(30)25-17-13-11-16(24)12-14-17/h2-14,21H,1H3,(H2,25,27,30)
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n/an/a 22n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50020268
PNG
((R)-1-(4-Chloro-phenyl)-3-(1-methyl-2-oxo-5-phenyl...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C23H19ClN4O2/c1-28-19-10-6-5-9-18(19)20(15-7-3-2-4-8-15)26-21(22(28)29)27-23(30)25-17-13-11-16(24)12-14-17/h2-14,21H,1H3,(H2,25,27,30)
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n/an/a 23n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)		BDBM50281701
PNG
(1-(4-Chloro-phenyl)-3-((S)-1-methyl-2-oxo-5-phenyl...)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C23H19ClN4O2/c1-28-19-10-6-5-9-18(19)20(15-7-3-2-4-8-15)26-21(22(28)29)27-23(30)25-17-13-11-16(24)12-14-17/h2-14,21H,1H3,(H2,25,27,30)/t21-/m1/s1
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n/an/a 26n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)		BDBM50020268
PNG
((R)-1-(4-Chloro-phenyl)-3-(1-methyl-2-oxo-5-phenyl...)
Show SMILES CN1c2ccccc2C(=NC(NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C23H19ClN4O2/c1-28-19-10-6-5-9-18(19)20(15-7-3-2-4-8-15)26-21(22(28)29)27-23(30)25-17-13-11-16(24)12-14-17/h2-14,21H,1H3,(H2,25,27,30)
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n/an/a 51n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)		BDBM50019206
PNG
((RS)-[3-(4-Chloro-benzoylamino)-5-(2-fluoro-phenyl...)
Show SMILES CCOC(=O)CN1c2ccccc2C(=NC(NC(=O)c2ccc(Cl)cc2)C1=O)c1ccccc1F |c:14|
Show InChI InChI=1S/C26H21ClFN3O4/c1-2-35-22(32)15-31-21-10-6-4-8-19(21)23(18-7-3-5-9-20(18)28)29-24(26(31)34)30-25(33)16-11-13-17(27)14-12-16/h3-14,24H,2,15H2,1H3,(H,30,33)
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n/an/a 110n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)		BDBM50020272
PNG
((RS)-1-(4-Chloro-phenyl)-3-[5-(2-fluoro-phenyl)-2-...)
Show SMILES Fc1ccccc1C1=NC(NC(=O)Nc2ccc(Cl)cc2)C(=O)Nc2ccccc12 |t:8|
Show InChI InChI=1S/C22H16ClFN4O2/c23-13-9-11-14(12-10-13)25-22(30)28-20-21(29)26-18-8-4-2-6-16(18)19(27-20)15-5-1-3-7-17(15)24/h1-12,20H,(H,26,29)(H2,25,28,30)
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n/an/a 110n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50061220
PNG
(1-((S)-1-Methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benz...)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)Nc2cccc(C)c2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C24H22N4O2/c1-16-9-8-12-18(15-16)25-24(30)27-22-23(29)28(2)20-14-7-6-13-19(20)21(26-22)17-10-4-3-5-11-17/h3-15,22H,1-2H3,(H2,25,27,30)/t22-/m1/s1
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n/an/a 130n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50061220
PNG
(1-((S)-1-Methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benz...)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)Nc2cccc(C)c2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C24H22N4O2/c1-16-9-8-12-18(15-16)25-24(30)27-22-23(29)28(2)20-14-7-6-13-19(20)21(26-22)17-10-4-3-5-11-17/h3-15,22H,1-2H3,(H2,25,27,30)/t22-/m1/s1
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n/an/a 151n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)		BDBM50020271
PNG
((RS)-[3-[3-(4-Chloro-phenyl)-ureido]-5-(2-fluoro-p...)
Show SMILES CCOC(=O)CN1c2ccccc2C(=NC(NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1F |c:14|
Show InChI InChI=1S/C26H22ClFN4O4/c1-2-36-22(33)15-32-21-10-6-4-8-19(21)23(18-7-3-5-9-20(18)28)30-24(25(32)34)31-26(35)29-17-13-11-16(27)12-14-17/h3-14,24H,2,15H2,1H3,(H2,29,31,35)
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n/an/a 220n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50005463
PNG
((R)-1H-Indole-2-carboxylic acid (1-methyl-2-oxo-5-...)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)c2cc3ccccc3[nH]2)C1=O)c1ccccc1 |r,c:9|
Show InChI InChI=1S/C25H20N4O2/c1-29-21-14-8-6-12-18(21)22(16-9-3-2-4-10-16)27-23(25(29)31)28-24(30)20-15-17-11-5-7-13-19(17)26-20/h2-15,23,26H,1H3,(H,28,30)/t23-/m1/s1
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n/an/a 245n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)		BDBM81962
PNG
(S-L-365,260)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2cccc(C)c2)C1=O)c1ccccc1 |r,c:9|
Show InChI InChI=1S/C24H22N4O2/c1-16-9-8-12-18(15-16)25-24(30)27-22-23(29)28(2)20-14-7-6-13-19(20)21(26-22)17-10-4-3-5-11-17/h3-15,22H,1-2H3,(H2,25,27,30)/t22-/m0/s1
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n/an/a 280n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50020272
PNG
((RS)-1-(4-Chloro-phenyl)-3-[5-(2-fluoro-phenyl)-2-...)
Show SMILES Fc1ccccc1C1=NC(NC(=O)Nc2ccc(Cl)cc2)C(=O)Nc2ccccc12 |t:8|
Show InChI InChI=1S/C22H16ClFN4O2/c23-13-9-11-14(12-10-13)25-22(30)28-20-21(29)26-18-8-4-2-6-16(18)19(27-20)15-5-1-3-7-17(15)24/h1-12,20H,(H,26,29)(H2,25,28,30)
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n/an/a 300n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50005463
PNG
((R)-1H-Indole-2-carboxylic acid (1-methyl-2-oxo-5-...)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)c2cc3ccccc3[nH]2)C1=O)c1ccccc1 |r,c:9|
Show InChI InChI=1S/C25H20N4O2/c1-29-21-14-8-6-12-18(21)22(16-9-3-2-4-10-16)27-23(25(29)31)28-24(30)20-15-17-11-5-7-13-19(17)26-20/h2-15,23,26H,1H3,(H,28,30)/t23-/m1/s1
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n/an/a 300n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of 125 I-gastrin from gastrin receptor of guinea pig gastric glands

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)		BDBM50020269
PNG
((RS)-{3-[3-(4-Chloro-phenyl)-ureido]-2-oxo-5-pheny...)
Show SMILES CCOC(=O)CN1c2ccccc2C(=NC(NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1 |c:14|
Show InChI InChI=1S/C26H23ClN4O4/c1-2-35-22(32)16-31-21-11-7-6-10-20(21)23(17-8-4-3-5-9-17)29-24(25(31)33)30-26(34)28-19-14-12-18(27)13-15-19/h3-15,24H,2,16H2,1H3,(H2,28,30,34)
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n/an/a 370n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50281701
PNG
(1-(4-Chloro-phenyl)-3-((S)-1-methyl-2-oxo-5-phenyl...)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C23H19ClN4O2/c1-28-19-10-6-5-9-18(19)20(15-7-3-2-4-8-15)26-21(22(28)29)27-23(30)25-17-13-11-16(24)12-14-17/h2-14,21H,1H3,(H2,25,27,30)/t21-/m1/s1
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n/an/a 410n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)		BDBM50020270
PNG
((RS)-1-(4-Chloro-phenyl)-3-[2-oxo-1-(2-oxo-2-pyrro...)
Show SMILES Clc1ccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)N3CCCC3)C2=O)cc1 |t:10|
Show InChI InChI=1S/C28H26ClN5O3/c29-20-12-14-21(15-13-20)30-28(37)32-26-27(36)34(18-24(35)33-16-6-7-17-33)23-11-5-4-10-22(23)25(31-26)19-8-2-1-3-9-19/h1-5,8-15,26H,6-7,16-18H2,(H2,30,32,37)
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n/an/a 520n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50281701
PNG
(1-(4-Chloro-phenyl)-3-((S)-1-methyl-2-oxo-5-phenyl...)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C23H19ClN4O2/c1-28-19-10-6-5-9-18(19)20(15-7-3-2-4-8-15)26-21(22(28)29)27-23(30)25-17-13-11-16(24)12-14-17/h2-14,21H,1H3,(H2,25,27,30)/t21-/m1/s1
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n/an/a 540n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of 125 I-gastrin from gastrin receptor of guinea pig gastric glands

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50020272
PNG
((RS)-1-(4-Chloro-phenyl)-3-[5-(2-fluoro-phenyl)-2-...)
Show SMILES Fc1ccccc1C1=NC(NC(=O)Nc2ccc(Cl)cc2)C(=O)Nc2ccccc12 |t:8|
Show InChI InChI=1S/C22H16ClFN4O2/c23-13-9-11-14(12-10-13)25-22(30)28-20-21(29)26-18-8-4-2-6-16(18)19(27-20)15-5-1-3-7-17(15)24/h1-12,20H,(H,26,29)(H2,25,28,30)
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n/an/a 640n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of 125 I-gastrin from gastrin receptor of guinea pig gastric glands

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50019206
PNG
((RS)-[3-(4-Chloro-benzoylamino)-5-(2-fluoro-phenyl...)
Show SMILES CCOC(=O)CN1c2ccccc2C(=NC(NC(=O)c2ccc(Cl)cc2)C1=O)c1ccccc1F |c:14|
Show InChI InChI=1S/C26H21ClFN3O4/c1-2-35-22(32)15-31-21-10-6-4-8-19(21)23(18-7-3-5-9-20(18)28)29-24(26(31)34)30-25(33)16-11-13-17(27)14-12-16/h3-14,24H,2,15H2,1H3,(H,30,33)
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n/an/a 690n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of 125 I-gastrin from gastrin receptor of guinea pig gastric glands

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)		BDBM50281711
PNG
(1-(4-Chloro-phenyl)-3-((R)-1-methyl-2-oxo-5-phenyl...)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1 |c:9|
Show InChI InChI=1S/C23H19ClN4O2/c1-28-19-10-6-5-9-18(19)20(15-7-3-2-4-8-15)26-21(22(28)29)27-23(30)25-17-13-11-16(24)12-14-17/h2-14,21H,1H3,(H2,25,27,30)/t21-/m0/s1
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n/an/a 1.10E+3n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50019206
PNG
((RS)-[3-(4-Chloro-benzoylamino)-5-(2-fluoro-phenyl...)
Show SMILES CCOC(=O)CN1c2ccccc2C(=NC(NC(=O)c2ccc(Cl)cc2)C1=O)c1ccccc1F |c:14|
Show InChI InChI=1S/C26H21ClFN3O4/c1-2-35-22(32)15-31-21-10-6-4-8-19(21)23(18-7-3-5-9-20(18)28)29-24(26(31)34)30-25(33)16-11-13-17(27)14-12-16/h3-14,24H,2,15H2,1H3,(H,30,33)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of 125 I-gastrin from gastrin receptor of guinea pig gastric glands

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50367623
PNG
(CHEMBL1907852)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)c2ccc(Cl)cc2)C1=O)c1ccccc1F |r,c:9|
Show InChI InChI=1S/C23H17ClFN3O2/c1-28-19-9-5-3-7-17(19)20(16-6-2-4-8-18(16)25)26-21(23(28)30)27-22(29)14-10-12-15(24)13-11-14/h2-13,21H,1H3,(H,27,29)/t21-/m1/s1
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n/an/a 2.50E+3n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of 125 I-gastrin from gastrin receptor of guinea pig gastric glands

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50367623
PNG
(CHEMBL1907852)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)c2ccc(Cl)cc2)C1=O)c1ccccc1F |r,c:9|
Show InChI InChI=1S/C23H17ClFN3O2/c1-28-19-9-5-3-7-17(19)20(16-6-2-4-8-18(16)25)26-21(23(28)30)27-22(29)14-10-12-15(24)13-11-14/h2-13,21H,1H3,(H,27,29)/t21-/m1/s1
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n/an/a 2.90E+3n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50452491
PNG
(CHEMBL2092868)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)c2ccc(Cl)cc2)C1=O)c1ccccc1F |r,c:9|
Show InChI InChI=1S/C23H17ClFN3O2/c1-28-19-9-5-3-7-17(19)20(16-6-2-4-8-18(16)25)26-21(23(28)30)27-22(29)14-10-12-15(24)13-11-14/h2-13,21H,1H3,(H,27,29)/t21-/m0/s1
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n/an/a 7.60E+3n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))		BDBM50452491
PNG
(CHEMBL2092868)
Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)c2ccc(Cl)cc2)C1=O)c1ccccc1F |r,c:9|
Show InChI InChI=1S/C23H17ClFN3O2/c1-28-19-9-5-3-7-17(19)20(16-6-2-4-8-18(16)25)26-21(23(28)30)27-22(29)14-10-12-15(24)13-11-14/h2-13,21H,1H3,(H,27,29)/t21-/m0/s1
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n/an/a 1.10E+4n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


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

J Med Chem 32: 13-6 (1989)


BindingDB Entry DOI: 10.7270/Q2MC90MG
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%