Found 18 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(Homo sapiens (Human)) | BDBM50226886
(CHEMBL1159912)Show SMILES CCCC[C@@H](CNCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C |r| Show InChI InChI=1S/C52H71N9O14S/c1-6-8-17-35(56-48(67)41(61-51(70)74-52(3,4)5)26-33-21-23-36(24-22-33)75-76(71,72)73)30-54-31-44(62)57-42(27-34-29-55-38-20-14-13-18-37(34)38)49(68)58-39(19-9-7-2)47(66)60-43(28-45(63)64)50(69)59-40(46(53)65)25-32-15-11-10-12-16-32/h10-16,18,20-24,29,35,39-43,54-55H,6-9,17,19,25-28,30-31H2,1-5H3,(H2,53,65)(H,56,67)(H,57,62)(H,58,68)(H,59,69)(H,60,66)(H,61,70)(H,63,64)(H,71,72,73)/t35-,39-,40-,41-,42-,43-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 0.5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of guinea pig brain membranes |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(Homo sapiens (Human)) | BDBM50226896
(CHEMBL1159915)Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)[C@H](CC(O)=O)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C55H72N10O18S/c1-6-8-18-37(47(71)62-42(28-44(66)67)51(75)60-39(46(56)70)25-31-15-11-10-12-16-31)58-50(74)41(27-33-30-57-36-20-14-13-17-35(33)36)63-53(77)65-48(72)38(19-9-7-2)59-49(73)40(26-32-21-23-34(24-22-32)83-84(79,80)81)61-52(76)43(29-45(68)69)64-54(78)82-55(3,4)5/h10-17,20-24,30,37-43,57H,6-9,18-19,25-29H2,1-5H3,(H2,56,70)(H,58,74)(H,59,73)(H,60,75)(H,61,76)(H,62,71)(H,64,78)(H,66,67)(H,68,69)(H,79,80,81)(H2,63,65,72,77)/t37-,38-,39-,40-,41-,42-,43-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 0.600 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of guinea pig brain membranes |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(Homo sapiens (Human)) | BDBM50226885
(CHEMBL1159903)Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C)C(=O)NCCN[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C52H71N9O14S/c1-6-8-18-38(57-49(68)42(61-51(70)74-52(3,4)5)28-33-21-23-35(24-22-33)75-76(71,72)73)46(65)55-26-25-54-41(29-34-31-56-37-20-14-13-17-36(34)37)48(67)58-39(19-9-7-2)47(66)60-43(30-44(62)63)50(69)59-40(45(53)64)27-32-15-11-10-12-16-32/h10-17,20-24,31,38-43,54,56H,6-9,18-19,25-30H2,1-5H3,(H2,53,64)(H,55,65)(H,57,68)(H,58,67)(H,59,69)(H,60,66)(H,61,70)(H,62,63)(H,71,72,73)/t38-,39-,40-,41-,42-,43-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of guinea pig brain membranes |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(RAT) | BDBM50226896
(CHEMBL1159915)Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)[C@H](CC(O)=O)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C55H72N10O18S/c1-6-8-18-37(47(71)62-42(28-44(66)67)51(75)60-39(46(56)70)25-31-15-11-10-12-16-31)58-50(74)41(27-33-30-57-36-20-14-13-17-35(33)36)63-53(77)65-48(72)38(19-9-7-2)59-49(73)40(26-32-21-23-34(24-22-32)83-84(79,80)81)61-52(76)43(29-45(68)69)64-54(78)82-55(3,4)5/h10-17,20-24,30,37-43,57H,6-9,18-19,25-29H2,1-5H3,(H2,56,70)(H,58,74)(H,59,73)(H,60,75)(H,61,76)(H,62,71)(H,64,78)(H,66,67)(H,68,69)(H,79,80,81)(H2,63,65,72,77)/t37-,38-,39-,40-,41-,42-,43-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of rat pancreatic acini |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(RAT) | BDBM50226886
(CHEMBL1159912)Show SMILES CCCC[C@@H](CNCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C |r| Show InChI InChI=1S/C52H71N9O14S/c1-6-8-17-35(56-48(67)41(61-51(70)74-52(3,4)5)26-33-21-23-36(24-22-33)75-76(71,72)73)30-54-31-44(62)57-42(27-34-29-55-38-20-14-13-18-37(34)38)49(68)58-39(19-9-7-2)47(66)60-43(28-45(63)64)50(69)59-40(46(53)65)25-32-15-11-10-12-16-32/h10-16,18,20-24,29,35,39-43,54-55H,6-9,17,19,25-28,30-31H2,1-5H3,(H2,53,65)(H,56,67)(H,57,62)(H,58,68)(H,59,69)(H,60,66)(H,61,70)(H,63,64)(H,71,72,73)/t35-,39-,40-,41-,42-,43-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of rat pancreatic acini |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(RAT) | BDBM50226893
(CHEMBL1159906)Show SMILES CCCC[C@H](NC[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C51H69N9O14S2/c1-6-7-16-38(47(66)59-42(27-44(62)63)49(68)58-40(45(52)64)24-31-13-9-8-10-14-31)54-29-34(26-33-28-53-37-17-12-11-15-36(33)37)56-43(61)30-55-46(65)39(22-23-75-5)57-48(67)41(60-50(69)73-51(2,3)4)25-32-18-20-35(21-19-32)74-76(70,71)72/h8-15,17-21,28,34,38-42,53-54H,6-7,16,22-27,29-30H2,1-5H3,(H2,52,64)(H,55,65)(H,56,61)(H,57,67)(H,58,68)(H,59,66)(H,60,69)(H,62,63)(H,70,71,72)/t34-,38-,39-,40-,41-,42-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of rat pancreatic acini |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(Homo sapiens (Human)) | BDBM50226887
(CHEMBL1159910)Show SMILES CCCC[C@H](NC[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C52H71N9O14S/c1-6-8-18-39(48(67)60-43(28-45(63)64)50(69)59-41(46(53)65)25-32-15-11-10-12-16-32)55-30-35(27-34-29-54-38-20-14-13-17-37(34)38)57-44(62)31-56-47(66)40(19-9-7-2)58-49(68)42(61-51(70)74-52(3,4)5)26-33-21-23-36(24-22-33)75-76(71,72)73/h10-17,20-24,29,35,39-43,54-55H,6-9,18-19,25-28,30-31H2,1-5H3,(H2,53,65)(H,56,66)(H,57,62)(H,58,68)(H,59,69)(H,60,67)(H,61,70)(H,63,64)(H,71,72,73)/t35-,39-,40-,41-,42-,43-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of guinea pig brain membranes |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(RAT) | BDBM50226888
(CHEMBL1159904)Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CN[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)CC(C)C |r| Show InChI InChI=1S/C52H71N9O14S/c1-7-8-17-39(59-50(69)42(61-51(70)74-52(4,5)6)25-33-19-21-36(22-20-33)75-76(71,72)73)47(66)56-30-44(62)58-43(26-34-28-54-38-18-13-12-16-37(34)38)49(68)57-35(23-31(2)3)29-55-41(27-45(63)64)48(67)60-40(46(53)65)24-32-14-10-9-11-15-32/h9-16,18-22,28,31,35,39-43,54-55H,7-8,17,23-27,29-30H2,1-6H3,(H2,53,65)(H,56,66)(H,57,68)(H,58,62)(H,59,69)(H,60,67)(H,61,70)(H,63,64)(H,71,72,73)/t35-,39-,40-,41-,42-,43-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of rat pancreatic acini |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(RAT) | BDBM50226894
(CHEMBL1159905)Show SMILES CCCC[C@@H](CN[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C |r| Show InChI InChI=1S/C51H69N9O14S2/c1-6-7-15-34(29-54-40(27-44(62)63)47(66)59-39(45(52)64)24-31-13-9-8-10-14-31)56-48(67)42(26-33-28-53-37-17-12-11-16-36(33)37)57-43(61)30-55-46(65)38(22-23-75-5)58-49(68)41(60-50(69)73-51(2,3)4)25-32-18-20-35(21-19-32)74-76(70,71)72/h8-14,16-21,28,34,38-42,53-54H,6-7,15,22-27,29-30H2,1-5H3,(H2,52,64)(H,55,65)(H,56,67)(H,57,61)(H,58,68)(H,59,66)(H,60,69)(H,62,63)(H,70,71,72)/t34-,38-,39-,40-,41-,42-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of rat pancreatic acini |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(RAT) | BDBM50226885
(CHEMBL1159903)Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C)C(=O)NCCN[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C52H71N9O14S/c1-6-8-18-38(57-49(68)42(61-51(70)74-52(3,4)5)28-33-21-23-35(24-22-33)75-76(71,72)73)46(65)55-26-25-54-41(29-34-31-56-37-20-14-13-17-36(34)37)48(67)58-39(19-9-7-2)47(66)60-43(30-44(62)63)50(69)59-40(45(53)64)27-32-15-11-10-12-16-32/h10-17,20-24,31,38-43,54,56H,6-9,18-19,25-30H2,1-5H3,(H2,53,64)(H,55,65)(H,57,68)(H,58,67)(H,59,69)(H,60,66)(H,61,70)(H,62,63)(H,71,72,73)/t38-,39-,40-,41-,42-,43-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of rat pancreatic acini |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(RAT) | BDBM50226892
(CHEMBL1159911)Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@H](CN[C@@H](Cc1ccccc1)C(N)=O)CC(O)=O |r| Show InChI InChI=1S/C51H69N9O14S2/c1-6-7-16-38(47(66)56-34(27-44(62)63)29-54-40(45(52)64)24-31-13-9-8-10-14-31)58-49(68)42(26-33-28-53-37-17-12-11-15-36(33)37)57-43(61)30-55-46(65)39(22-23-75-5)59-48(67)41(60-50(69)73-51(2,3)4)25-32-18-20-35(21-19-32)74-76(70,71)72/h8-15,17-21,28,34,38-42,53-54H,6-7,16,22-27,29-30H2,1-5H3,(H2,52,64)(H,55,65)(H,56,66)(H,57,61)(H,58,68)(H,59,67)(H,60,69)(H,62,63)(H,70,71,72)/t34-,38-,39-,40-,41-,42-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of rat pancreatic acini |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(Homo sapiens (Human)) | BDBM50226895
(CHEMBL1159909)Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@H](CN[C@@H](Cc1ccccc1)C(N)=O)CC(O)=O |r| Show InChI InChI=1S/C52H71N9O14S/c1-6-8-18-39(59-49(68)42(61-51(70)74-52(3,4)5)26-33-21-23-36(24-22-33)75-76(71,72)73)47(66)56-31-44(62)58-43(27-34-29-54-38-20-14-13-17-37(34)38)50(69)60-40(19-9-7-2)48(67)57-35(28-45(63)64)30-55-41(46(53)65)25-32-15-11-10-12-16-32/h10-17,20-24,29,35,39-43,54-55H,6-9,18-19,25-28,30-31H2,1-5H3,(H2,53,65)(H,56,66)(H,57,67)(H,58,62)(H,59,68)(H,60,69)(H,61,70)(H,63,64)(H,71,72,73)/t35-,39-,40-,41-,42-,43-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of guinea pig brain membranes |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(RAT) | BDBM50226895
(CHEMBL1159909)Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@H](CN[C@@H](Cc1ccccc1)C(N)=O)CC(O)=O |r| Show InChI InChI=1S/C52H71N9O14S/c1-6-8-18-39(59-49(68)42(61-51(70)74-52(3,4)5)26-33-21-23-36(24-22-33)75-76(71,72)73)47(66)56-31-44(62)58-43(27-34-29-54-38-20-14-13-17-37(34)38)50(69)60-40(19-9-7-2)48(67)57-35(28-45(63)64)30-55-41(46(53)65)25-32-15-11-10-12-16-32/h10-17,20-24,29,35,39-43,54-55H,6-9,18-19,25-28,30-31H2,1-5H3,(H2,53,65)(H,56,66)(H,57,67)(H,58,62)(H,59,68)(H,60,69)(H,61,70)(H,63,64)(H,71,72,73)/t35-,39-,40-,41-,42-,43-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of rat pancreatic acini |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(Homo sapiens (Human)) | BDBM50226888
(CHEMBL1159904)Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CN[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)CC(C)C |r| Show InChI InChI=1S/C52H71N9O14S/c1-7-8-17-39(59-50(69)42(61-51(70)74-52(4,5)6)25-33-19-21-36(22-20-33)75-76(71,72)73)47(66)56-30-44(62)58-43(26-34-28-54-38-18-13-12-16-37(34)38)49(68)57-35(23-31(2)3)29-55-41(27-45(63)64)48(67)60-40(46(53)65)24-32-14-10-9-11-15-32/h9-16,18-22,28,31,35,39-43,54-55H,7-8,17,23-27,29-30H2,1-6H3,(H2,53,65)(H,56,66)(H,57,68)(H,58,62)(H,59,69)(H,60,67)(H,61,70)(H,63,64)(H,71,72,73)/t35-,39-,40-,41-,42-,43-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of guinea pig brain membranes |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(RAT) | BDBM50226887
(CHEMBL1159910)Show SMILES CCCC[C@H](NC[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C52H71N9O14S/c1-6-8-18-39(48(67)60-43(28-45(63)64)50(69)59-41(46(53)65)25-32-15-11-10-12-16-32)55-30-35(27-34-29-54-38-20-14-13-17-37(34)38)57-44(62)31-56-47(66)40(19-9-7-2)58-49(68)42(61-51(70)74-52(3,4)5)26-33-21-23-36(24-22-33)75-76(71,72)73/h10-17,20-24,29,35,39-43,54-55H,6-9,18-19,25-28,30-31H2,1-5H3,(H2,53,65)(H,56,66)(H,57,62)(H,58,68)(H,59,69)(H,60,67)(H,61,70)(H,63,64)(H,71,72,73)/t35-,39-,40-,41-,42-,43-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 800 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of rat pancreatic acini |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(Homo sapiens (Human)) | BDBM50226894
(CHEMBL1159905)Show SMILES CCCC[C@@H](CN[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C |r| Show InChI InChI=1S/C51H69N9O14S2/c1-6-7-15-34(29-54-40(27-44(62)63)47(66)59-39(45(52)64)24-31-13-9-8-10-14-31)56-48(67)42(26-33-28-53-37-17-12-11-16-36(33)37)57-43(61)30-55-46(65)38(22-23-75-5)58-49(68)41(60-50(69)73-51(2,3)4)25-32-18-20-35(21-19-32)74-76(70,71)72/h8-14,16-21,28,34,38-42,53-54H,6-7,15,22-27,29-30H2,1-5H3,(H2,52,64)(H,55,65)(H,56,67)(H,57,61)(H,58,68)(H,59,66)(H,60,69)(H,62,63)(H,70,71,72)/t34-,38-,39-,40-,41-,42-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of guinea pig brain membranes |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(Homo sapiens (Human)) | BDBM50226893
(CHEMBL1159906)Show SMILES CCCC[C@H](NC[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C51H69N9O14S2/c1-6-7-16-38(47(66)59-42(27-44(62)63)49(68)58-40(45(52)64)24-31-13-9-8-10-14-31)54-29-34(26-33-28-53-37-17-12-11-15-36(33)37)56-43(61)30-55-46(65)39(22-23-75-5)57-48(67)41(60-50(69)73-51(2,3)4)25-32-18-20-35(21-19-32)74-76(70,71)72/h8-15,17-21,28,34,38-42,53-54H,6-7,16,22-27,29-30H2,1-5H3,(H2,52,64)(H,55,65)(H,56,61)(H,57,67)(H,58,68)(H,59,66)(H,60,69)(H,62,63)(H,70,71,72)/t34-,38-,39-,40-,41-,42-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 6.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of guinea pig brain membranes |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
Cholecystokinin receptor type A/Gastrin/cholecystokinin type B receptor
(Homo sapiens (Human)) | BDBM50226892
(CHEMBL1159911)Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@H](CN[C@@H](Cc1ccccc1)C(N)=O)CC(O)=O |r| Show InChI InChI=1S/C51H69N9O14S2/c1-6-7-16-38(47(66)56-34(27-44(62)63)29-54-40(45(52)64)24-31-13-9-8-10-14-31)58-49(68)42(26-33-28-53-37-17-12-11-15-36(33)37)57-43(61)30-55-46(65)39(22-23-75-5)59-48(67)41(60-50(69)73-51(2,3)4)25-32-18-20-35(21-19-32)74-76(70,71)72/h8-15,17-21,28,34,38-42,53-54H,6-7,16,22-27,29-30H2,1-5H3,(H2,52,64)(H,55,65)(H,56,66)(H,57,61)(H,58,68)(H,59,67)(H,60,69)(H,62,63)(H,70,71,72)/t34-,38-,39-,40-,41-,42-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 7.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of [125I]BH-CCK-9 binding to Cholecystokinin receptor of guinea pig brain membranes |
J Med Chem 30: 1366-73 (1987)
BindingDB Entry DOI: 10.7270/Q2930WDK |
More data for this
Ligand-Target Pair | |
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