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Compile Data Set for Download or QSAR

Found 40 hits Enz. Inhib. hit(s) with all data for entry = 50005343   
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))
BDBM50035820
PNG
(Ac-Trp-L-3-MPt(Pr)-Asp-Phe-NH2 | CHEMBL37830)
Show SMILES CCCS[C@@H]1CCN([C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C34H42N6O7S/c1-3-15-48-28-13-14-40(34(47)27(37-20(2)41)17-22-19-36-24-12-8-7-11-23(22)24)30(28)33(46)39-26(18-29(42)43)32(45)38-25(31(35)44)16-21-9-5-4-6-10-21/h4-12,19,25-28,30,36H,3,13-18H2,1-2H3,(H2,35,44)(H,37,41)(H,38,45)(H,39,46)(H,42,43)/t25-,26-,27-,28+,30+/m0/s1
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n/an/a 0.450n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035832
PNG
(Ac-Trp-L-3-MPt(Et)-Asp-Phe-NH2 | CHEMBL35471)
Show SMILES CCS[C@@H]1CCN([C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C33H40N6O7S/c1-3-47-27-13-14-39(33(46)26(36-19(2)40)16-21-18-35-23-12-8-7-11-22(21)23)29(27)32(45)38-25(17-28(41)42)31(44)37-24(30(34)43)15-20-9-5-4-6-10-20/h4-12,18,24-27,29,35H,3,13-17H2,1-2H3,(H2,34,43)(H,36,40)(H,37,44)(H,38,45)(H,41,42)/t24-,25-,26-,27+,29+/m0/s1
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n/an/a 1.80n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035825
PNG
(Ac-Trp-L-3-MPt(Pr)-Asp-Phe-NH2 | CHEMBL34554)
Show SMILES CCCS[C@H]1CCN([C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C34H42N6O7S/c1-3-15-48-28-13-14-40(34(47)27(37-20(2)41)17-22-19-36-24-12-8-7-11-23(22)24)30(28)33(46)39-26(18-29(42)43)32(45)38-25(31(35)44)16-21-9-5-4-6-10-21/h4-12,19,25-28,30,36H,3,13-18H2,1-2H3,(H2,35,44)(H,37,41)(H,38,45)(H,39,46)(H,42,43)/t25-,26-,27-,28-,30+/m0/s1
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n/an/a 3.30n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035829
PNG
(Ac-Trp-L-3-MPt(Et)-Asp-Phe-NH2 | CHEMBL34853)
Show SMILES CCS[C@H]1CCN([C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C33H40N6O7S/c1-3-47-27-13-14-39(33(46)26(36-19(2)40)16-21-18-35-23-12-8-7-11-22(21)23)29(27)32(45)38-25(17-28(41)42)31(44)37-24(30(34)43)15-20-9-5-4-6-10-20/h4-12,18,24-27,29,35H,3,13-17H2,1-2H3,(H2,34,43)(H,36,40)(H,37,44)(H,38,45)(H,41,42)/t24-,25-,26-,27-,29+/m0/s1
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n/an/a 30n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035834
PNG
(Ac-Trp-L-3-MPt(Me)-Asp-Phe-NH2 | CHEMBL287753)
Show SMILES CS[C@@H]1CCN([C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C32H38N6O7S/c1-18(39)35-25(15-20-17-34-22-11-7-6-10-21(20)22)32(45)38-13-12-26(46-2)28(38)31(44)37-24(16-27(40)41)30(43)36-23(29(33)42)14-19-8-4-3-5-9-19/h3-11,17,23-26,28,34H,12-16H2,1-2H3,(H2,33,42)(H,35,39)(H,36,43)(H,37,44)(H,40,41)/t23-,24-,25-,26+,28+/m0/s1
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n/an/a 50n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035833
PNG
(Ac-Trp-D-3-MPt(Pr)-Asp-Phe-NH2 | CHEMBL37984)
Show SMILES CCCS[C@@H]1CCN([C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C34H42N6O7S/c1-3-15-48-28-13-14-40(34(47)27(37-20(2)41)17-22-19-36-24-12-8-7-11-23(22)24)30(28)33(46)39-26(18-29(42)43)32(45)38-25(31(35)44)16-21-9-5-4-6-10-21/h4-12,19,25-28,30,36H,3,13-18H2,1-2H3,(H2,35,44)(H,37,41)(H,38,45)(H,39,46)(H,42,43)/t25-,26-,27-,28+,30-/m0/s1
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n/an/a 70n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035822
PNG
(Ac-Trp-L-3-MPc(Me)-Asp-Phe-NH2 | CHEMBL37983)
Show SMILES CS[C@H]1CCN([C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C32H38N6O7S/c1-18(39)35-25(15-20-17-34-22-11-7-6-10-21(20)22)32(45)38-13-12-26(46-2)28(38)31(44)37-24(16-27(40)41)30(43)36-23(29(33)42)14-19-8-4-3-5-9-19/h3-11,17,23-26,28,34H,12-16H2,1-2H3,(H2,33,42)(H,35,39)(H,36,43)(H,37,44)(H,40,41)/t23-,24-,25-,26-,28+/m0/s1
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n/an/a 300n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035823
PNG
(Ac-Trp-D-Pro-Asp-Phe-NH2 | Ac-Trp-Pro-Asp-Phe-NH2 ...)
Show SMILES CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C31H36N6O7/c1-18(38)34-25(15-20-17-33-22-11-6-5-10-21(20)22)31(44)37-13-7-12-26(37)30(43)36-24(16-27(39)40)29(42)35-23(28(32)41)14-19-8-3-2-4-9-19/h2-6,8-11,17,23-26,33H,7,12-16H2,1H3,(H2,32,41)(H,34,38)(H,35,42)(H,36,43)(H,39,40)/t23-,24-,25-,26-/m0/s1
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n/an/a 600n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035828
PNG
(Ac-Trp-D-3-MPt(Pr)-Asp-Phe-NH2 | CHEMBL37900)
Show SMILES CCCS[C@H]1CCN([C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C34H42N6O7S/c1-3-15-48-28-13-14-40(34(47)27(37-20(2)41)17-22-19-36-24-12-8-7-11-23(22)24)30(28)33(46)39-26(18-29(42)43)32(45)38-25(31(35)44)16-21-9-5-4-6-10-21/h4-12,19,25-28,30,36H,3,13-18H2,1-2H3,(H2,35,44)(H,37,41)(H,38,45)(H,39,46)(H,42,43)/t25-,26-,27-,28-,30-/m0/s1
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n/an/a 600n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035821
PNG
(Ac-Trp-D-3-MPt(Et)-Asp-Phe-NH2 | CHEMBL34916)
Show SMILES CCS[C@@H]1CCN([C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C33H40N6O7S/c1-3-47-27-13-14-39(33(46)26(36-19(2)40)16-21-18-35-23-12-8-7-11-22(21)23)29(27)32(45)38-25(17-28(41)42)31(44)37-24(30(34)43)15-20-9-5-4-6-10-20/h4-12,18,24-27,29,35H,3,13-17H2,1-2H3,(H2,34,43)(H,36,40)(H,37,44)(H,38,45)(H,41,42)/t24-,25-,26-,27+,29-/m0/s1
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n/an/a 800n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035825
PNG
(Ac-Trp-L-3-MPt(Pr)-Asp-Phe-NH2 | CHEMBL34554)
Show SMILES CCCS[C@H]1CCN([C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C34H42N6O7S/c1-3-15-48-28-13-14-40(34(47)27(37-20(2)41)17-22-19-36-24-12-8-7-11-23(22)24)30(28)33(46)39-26(18-29(42)43)32(45)38-25(31(35)44)16-21-9-5-4-6-10-21/h4-12,19,25-28,30,36H,3,13-18H2,1-2H3,(H2,35,44)(H,37,41)(H,38,45)(H,39,46)(H,42,43)/t25-,26-,27-,28-,30+/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035828
PNG
(Ac-Trp-D-3-MPt(Pr)-Asp-Phe-NH2 | CHEMBL37900)
Show SMILES CCCS[C@H]1CCN([C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C34H42N6O7S/c1-3-15-48-28-13-14-40(34(47)27(37-20(2)41)17-22-19-36-24-12-8-7-11-23(22)24)30(28)33(46)39-26(18-29(42)43)32(45)38-25(31(35)44)16-21-9-5-4-6-10-21/h4-12,19,25-28,30,36H,3,13-18H2,1-2H3,(H2,35,44)(H,37,41)(H,38,45)(H,39,46)(H,42,43)/t25-,26-,27-,28-,30-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Compound was tested for binding affinity towards Cholecystokinin type A receptor by measuring its ability to displace [125I]-BH-CCK-8 from rat pancre...


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035823
PNG
(Ac-Trp-D-Pro-Asp-Phe-NH2 | Ac-Trp-Pro-Asp-Phe-NH2 ...)
Show SMILES CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C31H36N6O7/c1-18(38)34-25(15-20-17-33-22-11-6-5-10-21(20)22)31(44)37-13-7-12-26(37)30(43)36-24(16-27(39)40)29(42)35-23(28(32)41)14-19-8-3-2-4-9-19/h2-6,8-11,17,23-26,33H,7,12-16H2,1H3,(H2,32,41)(H,34,38)(H,35,42)(H,36,43)(H,39,40)/t23-,24-,25-,26-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035833
PNG
(Ac-Trp-D-3-MPt(Pr)-Asp-Phe-NH2 | CHEMBL37984)
Show SMILES CCCS[C@@H]1CCN([C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C34H42N6O7S/c1-3-15-48-28-13-14-40(34(47)27(37-20(2)41)17-22-19-36-24-12-8-7-11-23(22)24)30(28)33(46)39-26(18-29(42)43)32(45)38-25(31(35)44)16-21-9-5-4-6-10-21/h4-12,19,25-28,30,36H,3,13-18H2,1-2H3,(H2,35,44)(H,37,41)(H,38,45)(H,39,46)(H,42,43)/t25-,26-,27-,28+,30-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035820
PNG
(Ac-Trp-L-3-MPt(Pr)-Asp-Phe-NH2 | CHEMBL37830)
Show SMILES CCCS[C@@H]1CCN([C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C34H42N6O7S/c1-3-15-48-28-13-14-40(34(47)27(37-20(2)41)17-22-19-36-24-12-8-7-11-23(22)24)30(28)33(46)39-26(18-29(42)43)32(45)38-25(31(35)44)16-21-9-5-4-6-10-21/h4-12,19,25-28,30,36H,3,13-18H2,1-2H3,(H2,35,44)(H,37,41)(H,38,45)(H,39,46)(H,42,43)/t25-,26-,27-,28+,30+/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035831
PNG
(Ac-Trp-D-3-MPt(Et)-Asp-Phe-NH2 | CHEMBL290444)
Show SMILES CCS[C@H]1CCN([C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C33H40N6O7S/c1-3-47-27-13-14-39(33(46)26(36-19(2)40)16-21-18-35-23-12-8-7-11-22(21)23)29(27)32(45)38-25(17-28(41)42)31(44)37-24(30(34)43)15-20-9-5-4-6-10-20/h4-12,18,24-27,29,35H,3,13-17H2,1-2H3,(H2,34,43)(H,36,40)(H,37,44)(H,38,45)(H,41,42)/t24-,25-,26-,27-,29-/m0/s1
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n/an/a 2.50E+3n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035836
PNG
((S)-3-((S)-2-{[(S)-2-Acetylamino-3-(1H-indol-3-yl)...)
Show SMILES CC(C)C[C@H](N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C33H42N6O7/c1-19(2)14-28(39(4)33(46)27(36-20(3)40)16-22-18-35-24-13-9-8-12-23(22)24)32(45)38-26(17-29(41)42)31(44)37-25(30(34)43)15-21-10-6-5-7-11-21/h5-13,18-19,25-28,35H,14-17H2,1-4H3,(H2,34,43)(H,36,40)(H,37,44)(H,38,45)(H,41,42)/t25-,26-,27-,28-/m0/s1
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n/an/a 4.00E+3n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035826
PNG
((S)-3-((S)-2-{[(S)-2-Acetylamino-3-(1H-indol-3-yl)...)
Show SMILES C[C@H](N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C30H36N6O7/c1-17(36(3)30(43)25(33-18(2)37)14-20-16-32-22-12-8-7-11-21(20)22)28(41)35-24(15-26(38)39)29(42)34-23(27(31)40)13-19-9-5-4-6-10-19/h4-12,16-17,23-25,32H,13-15H2,1-3H3,(H2,31,40)(H,33,37)(H,34,42)(H,35,41)(H,38,39)/t17-,23-,24-,25-/m0/s1
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n/an/a 7.00E+3n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035829
PNG
(Ac-Trp-L-3-MPt(Et)-Asp-Phe-NH2 | CHEMBL34853)
Show SMILES CCS[C@H]1CCN([C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C33H40N6O7S/c1-3-47-27-13-14-39(33(46)26(36-19(2)40)16-21-18-35-23-12-8-7-11-22(21)23)29(27)32(45)38-25(17-28(41)42)31(44)37-24(30(34)43)15-20-9-5-4-6-10-20/h4-12,18,24-27,29,35H,3,13-17H2,1-2H3,(H2,34,43)(H,36,40)(H,37,44)(H,38,45)(H,41,42)/t24-,25-,26-,27-,29+/m0/s1
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n/an/a 9.00E+3n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035831
PNG
(Ac-Trp-D-3-MPt(Et)-Asp-Phe-NH2 | CHEMBL290444)
Show SMILES CCS[C@H]1CCN([C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C33H40N6O7S/c1-3-47-27-13-14-39(33(46)26(36-19(2)40)16-21-18-35-23-12-8-7-11-22(21)23)29(27)32(45)38-25(17-28(41)42)31(44)37-24(30(34)43)15-20-9-5-4-6-10-20/h4-12,18,24-27,29,35H,3,13-17H2,1-2H3,(H2,34,43)(H,36,40)(H,37,44)(H,38,45)(H,41,42)/t24-,25-,26-,27-,29-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035835
PNG
(CHEMBL285756 | Trp-D-4-MPt(Me)-Asp-Phe-NH2)
Show SMILES CS[C@H]1CC(N(C1)C(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C30H36N6O6S/c1-43-19-13-25(36(16-19)30(42)21(31)12-18-15-33-22-10-6-5-9-20(18)22)29(41)35-24(14-26(37)38)28(40)34-23(27(32)39)11-17-7-3-2-4-8-17/h2-10,15,19,21,23-25,33H,11-14,16,31H2,1H3,(H2,32,39)(H,34,40)(H,35,41)(H,37,38)/t19-,21-,23-,24-,25?/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035836
PNG
((S)-3-((S)-2-{[(S)-2-Acetylamino-3-(1H-indol-3-yl)...)
Show SMILES CC(C)C[C@H](N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C33H42N6O7/c1-19(2)14-28(39(4)33(46)27(36-20(3)40)16-22-18-35-24-13-9-8-12-23(22)24)32(45)38-26(17-29(41)42)31(44)37-25(30(34)43)15-21-10-6-5-7-11-21/h5-13,18-19,25-28,35H,14-17H2,1-4H3,(H2,34,43)(H,36,40)(H,37,44)(H,38,45)(H,41,42)/t25-,26-,27-,28-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035827
PNG
(Ac-Trp-L-4-MPc(Me)-Asp-Phe-NH2 | Ac-Trp-L-4-MPt(Me...)
Show SMILES CS[C@H]1C[C@H](N(C1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C32H38N6O7S/c1-18(39)35-26(13-20-16-34-23-11-7-6-10-22(20)23)32(45)38-17-21(46-2)14-27(38)31(44)37-25(15-28(40)41)30(43)36-24(29(33)42)12-19-8-4-3-5-9-19/h3-11,16,21,24-27,34H,12-15,17H2,1-2H3,(H2,33,42)(H,35,39)(H,36,43)(H,37,44)(H,40,41)/t21-,24-,25-,26-,27-/m0/s1
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Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035827
PNG
(Ac-Trp-L-4-MPc(Me)-Asp-Phe-NH2 | Ac-Trp-L-4-MPt(Me...)
Show SMILES CS[C@H]1C[C@H](N(C1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C32H38N6O7S/c1-18(39)35-26(13-20-16-34-23-11-7-6-10-22(20)23)32(45)38-17-21(46-2)14-27(38)31(44)37-25(15-28(40)41)30(43)36-24(29(33)42)12-19-8-4-3-5-9-19/h3-11,16,21,24-27,34H,12-15,17H2,1-2H3,(H2,33,42)(H,35,39)(H,36,43)(H,37,44)(H,40,41)/t21-,24-,25-,26-,27-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50453646
PNG
(CHEMBL2114402)
Show SMILES CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C31H36N6O7/c1-18(38)34-25(15-20-17-33-22-11-6-5-10-21(20)22)31(44)37-13-7-12-26(37)30(43)36-24(16-27(39)40)29(42)35-23(28(32)41)14-19-8-3-2-4-9-19/h2-6,8-11,17,23-26,33H,7,12-16H2,1H3,(H2,32,41)(H,34,38)(H,35,42)(H,36,43)(H,39,40)/t23-,24-,25-,26+/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035834
PNG
(Ac-Trp-L-3-MPt(Me)-Asp-Phe-NH2 | CHEMBL287753)
Show SMILES CS[C@@H]1CCN([C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C32H38N6O7S/c1-18(39)35-25(15-20-17-34-22-11-7-6-10-21(20)22)32(45)38-13-12-26(46-2)28(38)31(44)37-24(16-27(40)41)30(43)36-23(29(33)42)14-19-8-4-3-5-9-19/h3-11,17,23-26,28,34H,12-16H2,1-2H3,(H2,33,42)(H,35,39)(H,36,43)(H,37,44)(H,40,41)/t23-,24-,25-,26+,28+/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035835
PNG
(CHEMBL285756 | Trp-D-4-MPt(Me)-Asp-Phe-NH2)
Show SMILES CS[C@H]1CC(N(C1)C(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C30H36N6O6S/c1-43-19-13-25(36(16-19)30(42)21(31)12-18-15-33-22-10-6-5-9-20(18)22)29(41)35-24(14-26(37)38)28(40)34-23(27(32)39)11-17-7-3-2-4-8-17/h2-10,15,19,21,23-25,33H,11-14,16,31H2,1H3,(H2,32,39)(H,34,40)(H,35,41)(H,37,38)/t19-,21-,23-,24-,25?/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035819
PNG
(Ac-Trp-D-3-MPt(Me)-Asp-Phe-NH2 | CHEMBL37786)
Show SMILES CS[C@H]1CCN([C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C32H38N6O7S/c1-18(39)35-25(15-20-17-34-22-11-7-6-10-21(20)22)32(45)38-13-12-26(46-2)28(38)31(44)37-24(16-27(40)41)30(43)36-23(29(33)42)14-19-8-4-3-5-9-19/h3-11,17,23-26,28,34H,12-16H2,1-2H3,(H2,33,42)(H,35,39)(H,36,43)(H,37,44)(H,40,41)/t23-,24-,25-,26-,28-/m0/s1
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n/an/a 1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035830
PNG
(Ac-Trp-D-Nle(Me)-Asp-Phe-NH2 | CHEMBL35394)
Show SMILES CCCCC(NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C32H40N6O7/c1-3-4-13-24(36-31(44)26(35-19(2)39)16-21-18-34-23-14-9-8-12-22(21)23)30(43)38-27(17-28(40)41)32(45)37-25(29(33)42)15-20-10-6-5-7-11-20/h5-12,14,18,24-27,34H,3-4,13,15-17H2,1-2H3,(H2,33,42)(H,35,39)(H,36,44)(H,37,45)(H,38,43)(H,40,41)/t24?,25-,26-,27-/m0/s1
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Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035824
PNG
(Ac-Trp-D-3-MPc(Me)-Asp-Phe-NH2 | CHEMBL285051)
Show SMILES CS[C@@H]1CCN([C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C32H38N6O7S/c1-18(39)35-25(15-20-17-34-22-11-7-6-10-21(20)22)32(45)38-13-12-26(46-2)28(38)31(44)37-24(16-27(40)41)30(43)36-23(29(33)42)14-19-8-4-3-5-9-19/h3-11,17,23-26,28,34H,12-16H2,1-2H3,(H2,33,42)(H,35,39)(H,36,43)(H,37,44)(H,40,41)/t23-,24-,25-,26+,28-/m0/s1
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n/an/a 1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035822
PNG
(Ac-Trp-L-3-MPc(Me)-Asp-Phe-NH2 | CHEMBL37983)
Show SMILES CS[C@H]1CCN([C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C32H38N6O7S/c1-18(39)35-25(15-20-17-34-22-11-7-6-10-21(20)22)32(45)38-13-12-26(46-2)28(38)31(44)37-24(16-27(40)41)30(43)36-23(29(33)42)14-19-8-4-3-5-9-19/h3-11,17,23-26,28,34H,12-16H2,1-2H3,(H2,33,42)(H,35,39)(H,36,43)(H,37,44)(H,40,41)/t23-,24-,25-,26-,28+/m0/s1
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n/an/a 1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035830
PNG
(Ac-Trp-D-Nle(Me)-Asp-Phe-NH2 | CHEMBL35394)
Show SMILES CCCCC(NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C32H40N6O7/c1-3-4-13-24(36-31(44)26(35-19(2)39)16-21-18-34-23-14-9-8-12-22(21)23)30(43)38-27(17-28(40)41)32(45)37-25(29(33)42)15-20-10-6-5-7-11-20/h5-12,14,18,24-27,34H,3-4,13,15-17H2,1-2H3,(H2,33,42)(H,35,39)(H,36,44)(H,37,45)(H,38,43)(H,40,41)/t24?,25-,26-,27-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035832
PNG
(Ac-Trp-L-3-MPt(Et)-Asp-Phe-NH2 | CHEMBL35471)
Show SMILES CCS[C@@H]1CCN([C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C33H40N6O7S/c1-3-47-27-13-14-39(33(46)26(36-19(2)40)16-21-18-35-23-12-8-7-11-22(21)23)29(27)32(45)38-25(17-28(41)42)31(44)37-24(30(34)43)15-20-9-5-4-6-10-20/h4-12,18,24-27,29,35H,3,13-17H2,1-2H3,(H2,34,43)(H,36,40)(H,37,44)(H,38,45)(H,41,42)/t24-,25-,26-,27+,29+/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50453646
PNG
(CHEMBL2114402)
Show SMILES CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C31H36N6O7/c1-18(38)34-25(15-20-17-33-22-11-6-5-10-21(20)22)31(44)37-13-7-12-26(37)30(43)36-24(16-27(39)40)29(42)35-23(28(32)41)14-19-8-3-2-4-9-19/h2-6,8-11,17,23-26,33H,7,12-16H2,1H3,(H2,32,41)(H,34,38)(H,35,42)(H,36,43)(H,39,40)/t23-,24-,25-,26+/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035826
PNG
((S)-3-((S)-2-{[(S)-2-Acetylamino-3-(1H-indol-3-yl)...)
Show SMILES C[C@H](N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C30H36N6O7/c1-17(36(3)30(43)25(33-18(2)37)14-20-16-32-22-12-8-7-11-21(20)22)28(41)35-24(15-26(38)39)29(42)34-23(27(31)40)13-19-9-5-4-6-10-19/h4-12,16-17,23-25,32H,13-15H2,1-3H3,(H2,31,40)(H,33,37)(H,34,42)(H,35,41)(H,38,39)/t17-,23-,24-,25-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50035827
PNG
(Ac-Trp-L-4-MPc(Me)-Asp-Phe-NH2 | Ac-Trp-L-4-MPt(Me...)
Show SMILES CS[C@H]1C[C@H](N(C1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C32H38N6O7S/c1-18(39)35-26(13-20-16-34-23-11-7-6-10-22(20)23)32(45)38-17-21(46-2)14-27(38)31(44)37-25(15-28(40)41)30(43)36-24(29(33)42)12-19-8-4-3-5-9-19/h3-11,16,21,24-27,34H,12-15,17H2,1-2H3,(H2,33,42)(H,35,39)(H,36,43)(H,37,44)(H,40,41)/t21-,24-,25-,26-,27-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035824
PNG
(Ac-Trp-D-3-MPc(Me)-Asp-Phe-NH2 | CHEMBL285051)
Show SMILES CS[C@@H]1CCN([C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C32H38N6O7S/c1-18(39)35-25(15-20-17-34-22-11-7-6-10-21(20)22)32(45)38-13-12-26(46-2)28(38)31(44)37-24(16-27(40)41)30(43)36-23(29(33)42)14-19-8-4-3-5-9-19/h3-11,17,23-26,28,34H,12-16H2,1-2H3,(H2,33,42)(H,35,39)(H,36,43)(H,37,44)(H,40,41)/t23-,24-,25-,26+,28-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035819
PNG
(Ac-Trp-D-3-MPt(Me)-Asp-Phe-NH2 | CHEMBL37786)
Show SMILES CS[C@H]1CCN([C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C32H38N6O7S/c1-18(39)35-25(15-20-17-34-22-11-7-6-10-21(20)22)32(45)38-13-12-26(46-2)28(38)31(44)37-24(16-27(40)41)30(43)36-23(29(33)42)14-19-8-4-3-5-9-19/h3-11,17,23-26,28,34H,12-16H2,1-2H3,(H2,33,42)(H,35,39)(H,36,43)(H,37,44)(H,40,41)/t23-,24-,25-,26-,28-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035827
PNG
(Ac-Trp-L-4-MPc(Me)-Asp-Phe-NH2 | Ac-Trp-L-4-MPt(Me...)
Show SMILES CS[C@H]1C[C@H](N(C1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C32H38N6O7S/c1-18(39)35-26(13-20-16-34-23-11-7-6-10-22(20)23)32(45)38-17-21(46-2)14-27(38)31(44)37-25(15-28(40)41)30(43)36-24(29(33)42)12-19-8-4-3-5-9-19/h3-11,16,21,24-27,34H,12-15,17H2,1-2H3,(H2,33,42)(H,35,39)(H,36,43)(H,37,44)(H,40,41)/t21-,24-,25-,26-,27-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair
Cholecystokinin receptor type A


(RAT)
BDBM50035821
PNG
(Ac-Trp-D-3-MPt(Et)-Asp-Phe-NH2 | CHEMBL34916)
Show SMILES CCS[C@@H]1CCN([C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
Show InChI InChI=1S/C33H40N6O7S/c1-3-47-27-13-14-39(33(46)26(36-19(2)40)16-21-18-35-23-12-8-7-11-22(21)23)29(27)32(45)38-25(17-28(41)42)31(44)37-24(30(34)43)15-20-9-5-4-6-10-20/h4-12,18,24-27,29,35H,3,13-17H2,1-2H3,(H2,34,43)(H,36,40)(H,37,44)(H,38,45)(H,41,42)/t24-,25-,26-,27+,29-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini


J Med Chem 38: 137-49 (1995)


BindingDB Entry DOI: 10.7270/Q2QN65TS
More data for this
Ligand-Target Pair