Compile Data Set for Download or QSAR

Found 90 hits with Last Name = 'shue' and Initial = 'yk'   

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
Muscarinic acetylcholine receptor M2 (RAT)	BDBM50005854 (1-(4-Azetidin-1-yl-but-2-ynyl)-pyrrolidin-2-one | ...) Show SMILES O=C1CCCN1CC#CCN1CCC1 Show InChI InChI=1S/C11H16N2O/c14-11-5-3-10-13(11)9-2-1-6-12-7-4-8-12/h3-10H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	27	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards muscarinic acetylcholine receptor M2 in rat brainstem				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (RAT)	BDBM50004665 ((oxotremorine)1-(4-Pyrrolidin-1-yl-but-2-ynyl)-pyr...) Show SMILES O=C1CCCN1CC#CCN1CCCC1 Show InChI InChI=1S/C12H18N2O/c15-12-6-5-11-14(12)10-4-3-9-13-7-1-2-8-13/h1-2,5-11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	PubMed	84	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards muscarinic acetylcholine receptor M2 in rat brainstem				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM50004665 ((oxotremorine)1-(4-Pyrrolidin-1-yl-but-2-ynyl)-pyr...) Show SMILES O=C1CCCN1CC#CCN1CCCC1 Show InChI InChI=1S/C12H18N2O/c15-12-6-5-11-14(12)10-4-3-9-13-7-1-2-8-13/h1-2,5-11H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	PubMed	196	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards muscarinic acetylcholine receptor in rat cortex				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (RAT)	BDBM50455987 (CHEMBL2115360) Show SMILES O=C1CCCN1CC#CC[C@H]1CCCCN1 |r| Show InChI InChI=1S/C13H20N2O/c16-13-8-5-11-15(13)10-4-2-7-12-6-1-3-9-14-12/h12,14H,1,3,5-11H2/t12-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	636	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M2 receptor in rat brainstem				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (RAT)	BDBM50005851 (1-[4-(Ethyl-methyl-amino)-but-2-ynyl]-pyrrolidin-2...) Show SMILES CCN(C)CC#CCN1CCCC1=O Show InChI InChI=1S/C11H18N2O/c1-3-12(2)8-4-5-9-13-10-6-7-11(13)14/h3,6-10H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	813	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards muscarinic acetylcholine receptor M2 in rat brainstem				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (RAT)	BDBM50005856 (1-(4-Dimethylamino-but-2-ynyl)-pyrrolidin-2-one | ...) Show SMILES CN(C)CC#CCN1CCCC1=O Show InChI InChI=1S/C10H16N2O/c1-11(2)7-3-4-8-12-9-5-6-10(12)13/h5-9H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	926	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards Muscarinic acetylcholine receptor M2 in rat brainstem				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM50455986 (CHEMBL2115361) Show SMILES CN1CCCC[C@@H]1CC#CCN1CCCC1=O |r| Show InChI InChI=1S/C14H22N2O/c1-15-10-4-2-7-13(15)8-3-5-11-16-12-6-9-14(16)17/h13H,2,4,6-12H2,1H3/t13-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M1 receptor in rat cortex				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM50005854 (1-(4-Azetidin-1-yl-but-2-ynyl)-pyrrolidin-2-one | ...) Show SMILES O=C1CCCN1CC#CCN1CCC1 Show InChI InChI=1S/C11H16N2O/c14-11-5-3-10-13(11)9-2-1-6-12-7-4-8-12/h3-10H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.25E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards muscarinic acetylcholine receptor in rat cortex				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (RAT)	BDBM50455988 (CHEMBL2115359) Show SMILES O=C1CCCN1CC#CC[C@H]1CCCN1 |r| Show InChI InChI=1S/C12H18N2O/c15-12-7-4-10-14(12)9-2-1-5-11-6-3-8-13-11/h11,13H,3-10H2/t11-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.46E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M2 receptor in rat brainstem				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM50005851 (1-[4-(Ethyl-methyl-amino)-but-2-ynyl]-pyrrolidin-2...) Show SMILES CCN(C)CC#CCN1CCCC1=O Show InChI InChI=1S/C11H18N2O/c1-3-12(2)8-4-5-9-13-10-6-7-11(13)14/h3,6-10H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.69E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards muscarinic acetylcholine receptor in rat cortex				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM50455987 (CHEMBL2115360) Show SMILES O=C1CCCN1CC#CC[C@H]1CCCCN1 |r| Show InChI InChI=1S/C13H20N2O/c16-13-8-5-11-15(13)10-4-2-7-12-6-1-3-9-14-12/h12,14H,1,3,5-11H2/t12-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.03E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M1 receptor in rat cortex				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM50455988 (CHEMBL2115359) Show SMILES O=C1CCCN1CC#CC[C@H]1CCCN1 |r| Show InChI InChI=1S/C12H18N2O/c15-12-7-4-10-14(12)9-2-1-5-11-6-3-8-13-11/h11,13H,3-10H2/t11-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.07E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M1 receptor in rat cortex				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (RAT)	BDBM50455986 (CHEMBL2115361) Show SMILES CN1CCCC[C@@H]1CC#CCN1CCCC1=O |r| Show InChI InChI=1S/C14H22N2O/c1-15-10-4-2-7-13(15)8-3-5-11-16-12-6-9-14(16)17/h13H,2,4,6-12H2,1H3/t13-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.66E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M2 receptor in rat brainstem				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM50455982 (CHEMBL2114427) Show SMILES CN1CCCC[C@H]1CC#CCN1CCCC1=O |r| Show InChI InChI=1S/C14H22N2O/c1-15-10-4-2-7-13(15)8-3-5-11-16-12-6-9-14(16)17/h13H,2,4,6-12H2,1H3/t13-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.38E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M1 receptor in rat cortex				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM50455985 (CHEMBL2115362) Show SMILES CN1CCC[C@@H]1CC#CCN1CCCC1=O |r| Show InChI InChI=1S/C13H20N2O/c1-14-9-4-7-12(14)6-2-3-10-15-11-5-8-13(15)16/h12H,4-11H2,1H3/t12-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.46E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M1 receptor in rat cortex				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (RAT)	BDBM50455983 (CHEMBL2114425) Show SMILES O=C1CCCN1CC#CC[C@@H]1CCCN1 |r| Show InChI InChI=1S/C12H18N2O/c15-12-7-4-10-14(12)9-2-1-5-11-6-3-8-13-11/h11,13H,3-10H2/t11-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.64E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M2 receptor in rat brainstem				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (RAT)	BDBM50455985 (CHEMBL2115362) Show SMILES CN1CCC[C@@H]1CC#CCN1CCCC1=O |r| Show InChI InChI=1S/C13H20N2O/c1-14-9-4-7-12(14)6-2-3-10-15-11-5-8-13(15)16/h12H,4-11H2,1H3/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.86E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M2 receptor in rat brainstem				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (RAT)	BDBM50455982 (CHEMBL2114427) Show SMILES CN1CCCC[C@H]1CC#CCN1CCCC1=O |r| Show InChI InChI=1S/C14H22N2O/c1-15-10-4-2-7-13(15)8-3-5-11-16-12-6-9-14(16)17/h13H,2,4,6-12H2,1H3/t13-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7.06E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M2 receptor in rat brainstem				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM50455984 (CHEMBL2114430) Show SMILES CN1CCC[C@H]1CC#CCN1CCCC1=O |r| Show InChI InChI=1S/C13H20N2O/c1-14-9-4-7-12(14)6-2-3-10-15-11-5-8-13(15)16/h12H,4-11H2,1H3/t12-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.05E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M1 receptor in rat cortex				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (RAT)	BDBM50455984 (CHEMBL2114430) Show SMILES CN1CCC[C@H]1CC#CCN1CCCC1=O |r| Show InChI InChI=1S/C13H20N2O/c1-14-9-4-7-12(14)6-2-3-10-15-11-5-8-13(15)16/h12H,4-11H2,1H3/t12-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.08E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M2 receptor in rat brainstem				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (RAT)	BDBM50455981 (CHEMBL2114426) Show SMILES O=C1CCCN1CC#CC[C@@H]1CCCCN1 |r| Show InChI InChI=1S/C13H20N2O/c16-13-8-5-11-15(13)10-4-2-7-12-6-1-3-9-14-12/h12,14H,1,3,5-11H2/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.58E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M2 receptor in rat brainstem				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM50005856 (1-(4-Dimethylamino-but-2-ynyl)-pyrrolidin-2-one | ...) Show SMILES CN(C)CC#CCN1CCCC1=O Show InChI InChI=1S/C10H16N2O/c1-11(2)7-3-4-8-12-9-5-6-10(12)13/h5-9H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	1.59E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards Muscarinic acetylcholine receptor M1 in rat cortex				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM50455981 (CHEMBL2114426) Show SMILES O=C1CCCN1CC#CC[C@@H]1CCCCN1 |r| Show InChI InChI=1S/C13H20N2O/c16-13-8-5-11-15(13)10-4-2-7-12-6-1-3-9-14-12/h12,14H,1,3,5-11H2/t12-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.76E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M1 receptor in rat cortex				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (RAT)	BDBM50005855 (1-(4-Methylamino-but-2-ynyl)-pyrrolidin-2-one | CH...) Show SMILES CNCC#CCN1CCCC1=O Show InChI InChI=1S/C9H14N2O/c1-10-6-2-3-7-11-8-4-5-9(11)12/h10H,4-8H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.81E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards muscarinic acetylcholine receptor M2 in rat brainstem				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM50455983 (CHEMBL2114425) Show SMILES O=C1CCCN1CC#CC[C@@H]1CCCN1 |r| Show InChI InChI=1S/C12H18N2O/c15-12-7-4-10-14(12)9-2-1-5-11-6-3-8-13-11/h11,13H,3-10H2/t11-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.05E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards M1 receptor in rat cortex				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM50005855 (1-(4-Methylamino-but-2-ynyl)-pyrrolidin-2-one | CH...) Show SMILES CNCC#CCN1CCCC1=O Show InChI InChI=1S/C9H14N2O/c1-10-6-2-3-7-11-8-4-5-9(11)12/h10H,4-8H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	6.55E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards muscarinic acetylcholine receptor in rat cortex				J Med Chem 35: 1550-7 (1992) BindingDB Entry DOI: 10.7270/Q2MK6BT7
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044039 ((S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-[(S)-2-[(...) Show SMILES CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(C)(C)C Show InChI InChI=1S/C44H56N8O8/c1-27-15-9-11-19-31(27)51-43(60)46-22-14-13-21-33(48-40(57)34(50-42(59)44(2,3)4)24-29-26-47-32-20-12-10-18-30(29)32)39(56)49-35(25-37(53)54)41(58)52(5)36(38(45)55)23-28-16-7-6-8-17-28/h6-12,15-20,26,33-36,47H,13-14,21-25H2,1-5H3,(H2,45,55)(H,48,57)(H,49,56)(H,50,59)(H,53,54)(H2,46,51,60)/t33-,34-,35-,36-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044033 ((S)-3-[(S)-2-((S)-2-Benzoylamino-3-1H-indol-3-yl-p...) Show SMILES CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccccc1 Show InChI InChI=1S/C46H52N8O8/c1-29-15-9-11-21-34(29)53-46(62)48-24-14-13-23-36(43(59)52-38(27-40(55)56)45(61)54(2)39(41(47)57)25-30-16-5-3-6-17-30)50-44(60)37(51-42(58)31-18-7-4-8-19-31)26-32-28-49-35-22-12-10-20-33(32)35/h3-12,15-22,28,36-39,49H,13-14,23-27H2,1-2H3,(H2,47,57)(H,50,60)(H,51,58)(H,52,59)(H,55,56)(H2,48,53,62)/t36-,37-,38-,39-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.30	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044042 ((S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-[(S)-2-[2...) Show SMILES CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC(C)(C)C Show InChI InChI=1S/C45H58N8O8/c1-28-15-9-11-19-32(28)52-44(61)47-22-14-13-21-34(41(58)51-36(25-39(55)56)43(60)53(5)37(40(46)57)23-29-16-7-6-8-17-29)50-42(59)35(49-38(54)26-45(2,3)4)24-30-27-48-33-20-12-10-18-31(30)33/h6-12,15-20,27,34-37,48H,13-14,21-26H2,1-5H3,(H2,46,57)(H,49,54)(H,50,59)(H,51,58)(H,55,56)(H2,47,52,61)/t34-,35-,36-,37-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.40	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044028 ((S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-[(S)-2-((...) Show SMILES CC(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(O)=O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C43H54N8O9/c1-26(2)60-43(59)50-34(23-29-25-46-32-19-11-9-17-30(29)32)40(56)47-33(20-12-13-21-45-42(58)49-31-18-10-8-14-27(31)3)39(55)48-35(24-37(52)53)41(57)51(4)36(38(44)54)22-28-15-6-5-7-16-28/h5-11,14-19,25-26,33-36,46H,12-13,20-24H2,1-4H3,(H2,44,54)(H,47,56)(H,48,55)(H,50,59)(H,52,53)(H2,45,49,58)/t33-,34-,35-,36-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.60	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044038 ((S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-[(S)-2-[(...) Show SMILES CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)(F)F Show InChI InChI=1S/C41H47F3N8O8/c1-24-12-6-8-16-28(24)51-40(60)46-19-11-10-18-30(48-37(57)31(50-39(59)41(42,43)44)21-26-23-47-29-17-9-7-15-27(26)29)36(56)49-32(22-34(53)54)38(58)52(2)33(35(45)55)20-25-13-4-3-5-14-25/h3-9,12-17,23,30-33,47H,10-11,18-22H2,1-2H3,(H2,45,55)(H,48,57)(H,49,56)(H,50,59)(H,53,54)(H2,46,51,60)/t30-,31-,32-,33-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044044 ((S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-[(S)-2-((...) Show SMILES CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(O)=O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C42H52N8O8/c1-4-36(51)46-33(23-28-25-45-31-19-11-9-17-29(28)31)40(56)47-32(20-12-13-21-44-42(58)49-30-18-10-8-14-26(30)2)39(55)48-34(24-37(52)53)41(57)50(3)35(38(43)54)22-27-15-6-5-7-16-27/h5-11,14-19,25,32-35,45H,4,12-13,20-24H2,1-3H3,(H2,43,54)(H,46,51)(H,47,56)(H,48,55)(H,52,53)(H2,44,49,58)/t32-,33-,34-,35-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044032 ((S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-[(S)-2-[(...) Show SMILES CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C54H60N8O8/c1-35-18-12-14-26-42(35)61-54(70)56-29-17-16-28-44(51(67)60-46(33-49(64)65)53(69)62(2)47(50(55)66)30-36-19-6-3-7-20-36)59-52(68)45(31-39-34-57-43-27-15-13-25-40(39)43)58-48(63)32-41(37-21-8-4-9-22-37)38-23-10-5-11-24-38/h3-15,18-27,34,41,44-47,57H,16-17,28-33H2,1-2H3,(H2,55,66)(H,58,63)(H,59,68)(H,60,67)(H,64,65)(H2,56,61,70)/t44-,45-,46-,47-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044037 ((S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-[(S)-2-((...) Show SMILES CC(C)COC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(O)=O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C44H56N8O9/c1-27(2)26-61-44(60)51-35(23-30-25-47-33-19-11-9-17-31(30)33)41(57)48-34(20-12-13-21-46-43(59)50-32-18-10-8-14-28(32)3)40(56)49-36(24-38(53)54)42(58)52(4)37(39(45)55)22-29-15-6-5-7-16-29/h5-11,14-19,25,27,34-37,47H,12-13,20-24,26H2,1-4H3,(H2,45,55)(H,48,57)(H,49,56)(H,51,60)(H,53,54)(H2,46,50,59)/t34-,35-,36-,37-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.30	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044031 ((S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-[(S)-2-[(...) Show SMILES CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Nc1ccccc1 Show InChI InChI=1S/C46H53N9O8/c1-29-15-9-11-21-34(29)53-45(62)48-24-14-13-23-36(42(59)52-38(27-40(56)57)44(61)55(2)39(41(47)58)25-30-16-5-3-6-17-30)51-43(60)37(54-46(63)50-32-18-7-4-8-19-32)26-31-28-49-35-22-12-10-20-33(31)35/h3-12,15-22,28,36-39,49H,13-14,23-27H2,1-2H3,(H2,47,58)(H,51,60)(H,52,59)(H,56,57)(H2,48,53,62)(H2,50,54,63)/t36-,37-,38-,39-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50040523 ((S)-3-{[(S)-2-[(S)-2-tert-Butoxycarbonylamino-3-(1...) Show SMILES CN([C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C Show InChI InChI=1S/C44H56N8O9/c1-27-15-9-11-19-31(27)50-42(59)46-22-14-13-21-33(41(58)52(5)36(25-37(53)54)40(57)49-34(38(45)55)23-28-16-7-6-8-17-28)48-39(56)35(51-43(60)61-44(2,3)4)24-29-26-47-32-20-12-10-18-30(29)32/h6-12,15-20,26,33-36,47H,13-14,21-25H2,1-5H3,(H2,45,55)(H,48,56)(H,49,57)(H,51,60)(H,53,54)(H2,46,50,59)/t33-,34-,35-,36-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044025 ((S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-[(S)-2-[(...) Show SMILES COC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(O)=O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C41H50N8O9/c1-25-13-7-9-17-29(25)47-40(56)43-20-12-11-19-31(45-38(54)32(48-41(57)58-3)22-27-24-44-30-18-10-8-16-28(27)30)37(53)46-33(23-35(50)51)39(55)49(2)34(36(42)52)21-26-14-5-4-6-15-26/h4-10,13-18,24,31-34,44H,11-12,19-23H2,1-3H3,(H2,42,52)(H,45,54)(H,46,53)(H,48,57)(H,50,51)(H2,43,47,56)/t31-,32-,33-,34-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.90	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044043 ((S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-[(S)-2-((...) Show SMILES CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Oc1ccccc1 Show InChI InChI=1S/C46H52N8O9/c1-29-15-9-11-21-34(29)52-45(61)48-24-14-13-23-36(42(58)51-38(27-40(55)56)44(60)54(2)39(41(47)57)25-30-16-5-3-6-17-30)50-43(59)37(53-46(62)63-32-18-7-4-8-19-32)26-31-28-49-35-22-12-10-20-33(31)35/h3-12,15-22,28,36-39,49H,13-14,23-27H2,1-2H3,(H2,47,57)(H,50,59)(H,51,58)(H,53,62)(H,55,56)(H2,48,52,61)/t36-,37-,38-,39-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.10	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044022 ((S)-3-[(S)-2-[(S)-2-Acetylamino-3-(1H-indol-3-yl)-...) Show SMILES CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O Show InChI InChI=1S/C41H50N8O8/c1-25-13-7-9-17-30(25)48-41(57)43-20-12-11-19-32(46-39(55)33(45-26(2)50)22-28-24-44-31-18-10-8-16-29(28)31)38(54)47-34(23-36(51)52)40(56)49(3)35(37(42)53)21-27-14-5-4-6-15-27/h4-10,13-18,24,32-35,44H,11-12,19-23H2,1-3H3,(H2,42,53)(H,45,50)(H,46,55)(H,47,54)(H,51,52)(H2,43,48,57)/t32-,33-,34-,35-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.80	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044024 ((S)-3-[(S)-2-[2-((S)-3-tert-Butyl-ureido)-3-(1H-in...) Show SMILES CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)NC(C)(C)C Show InChI InChI=1S/C44H57N9O8/c1-27-15-9-11-19-31(27)50-42(60)46-22-14-13-21-33(39(57)49-35(25-37(54)55)41(59)53(5)36(38(45)56)23-28-16-7-6-8-17-28)48-40(58)34(51-43(61)52-44(2,3)4)24-29-26-47-32-20-12-10-18-30(29)32/h6-12,15-20,26,33-36,47H,13-14,21-25H2,1-5H3,(H2,45,56)(H,48,58)(H,49,57)(H,54,55)(H2,46,50,60)(H2,51,52,61)/t33-,34-,35-,36-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.40	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044040 ((S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-[(S)-2-[(...) Show SMILES CNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(O)=O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C41H51N9O8/c1-25-13-7-9-17-29(25)48-41(58)44-20-12-11-19-31(46-38(55)32(49-40(57)43-2)22-27-24-45-30-18-10-8-16-28(27)30)37(54)47-33(23-35(51)52)39(56)50(3)34(36(42)53)21-26-14-5-4-6-15-26/h4-10,13-18,24,31-34,45H,11-12,19-23H2,1-3H3,(H2,42,53)(H,46,55)(H,47,54)(H,51,52)(H2,43,49,57)(H2,44,48,58)/t31-,32-,33-,34-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.90	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044036 ((S)-3-[(S)-2-[(S)-2-Benzyloxycarbonylamino-3-(1H-i...) Show SMILES CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C47H54N8O9/c1-30-15-9-11-21-35(30)53-46(62)49-24-14-13-23-37(43(59)52-39(27-41(56)57)45(61)55(2)40(42(48)58)25-31-16-5-3-6-17-31)51-44(60)38(26-33-28-50-36-22-12-10-20-34(33)36)54-47(63)64-29-32-18-7-4-8-19-32/h3-12,15-22,28,37-40,50H,13-14,23-27,29H2,1-2H3,(H2,48,58)(H,51,60)(H,52,59)(H,54,63)(H,56,57)(H2,49,53,62)/t37-,38-,39-,40-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.20	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50041652 (CHEMBL41364 | [1-[(S)-1-({2-[(1-Carbamoyl-2-phenyl...) Show SMILES CN(CCC(=O)N(C)C(Cc1ccccc1)C(N)=O)C(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C Show InChI InChI=1S/C44H58N8O7/c1-29-16-10-12-20-33(29)49-42(57)46-24-15-14-22-35(41(56)51(5)25-23-38(53)52(6)37(39(45)54)26-30-17-8-7-9-18-30)48-40(55)36(50-43(58)59-44(2,3)4)27-31-28-47-34-21-13-11-19-32(31)34/h7-13,16-21,28,35-37,47H,14-15,22-27H2,1-6H3,(H2,45,54)(H,48,55)(H,50,58)(H2,46,49,57)/t35-,36?,37?/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Concentration that inhibited 50% of specific binding of [125I]-Bolton-Hunter CCK-8 binding in guinea pig pancreas				J Med Chem 37: 1562-8 (1994) BindingDB Entry DOI: 10.7270/Q2WD3ZMM
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044023 ((S)-3-[(S)-2-[(S)-2-(Adamantan-2-yloxycarbonylamin...) Show SMILES CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 |wU:15.20,42.56,wD:2.1,23.40,TLB:66:65:63:60.59.61,THB:66:60:57.65.64:63,56:57:63:60.59.61,61:62:57:60.59.66,61:60:57:62.64.63,(21.52,-7.7,;20.99,-9.32,;22.2,-10.21,;22.2,-11.76,;23.53,-12.53,;23.53,-14.07,;24.87,-14.84,;26.2,-14.07,;26.2,-12.53,;24.89,-11.6,;23.48,-9.35,;25.02,-9.35,;23.48,-7.8,;19.63,-10.04,;19.63,-11.59,;18.35,-9.18,;18.35,-7.63,;19.68,-6.86,;21.02,-7.63,;19.68,-5.32,;17.14,-10.06,;15.78,-9.35,;15.78,-7.8,;14.5,-10.21,;14.5,-11.76,;15.84,-12.53,;15.84,-14.07,;17.17,-14.84,;17.17,-16.37,;18.5,-17.14,;19.84,-16.37,;18.5,-18.68,;19.84,-19.45,;19.83,-20.99,;21.16,-21.76,;22.48,-20.99,;22.48,-19.44,;21.16,-18.68,;21.15,-17.14,;13.29,-9.32,;11.93,-10.04,;11.94,-11.59,;10.65,-9.18,;10.65,-7.63,;11.99,-6.86,;13.48,-7.21,;14.27,-5.88,;13.26,-4.73,;13.45,-3.19,;12.22,-2.27,;10.8,-2.87,;10.62,-4.4,;11.85,-5.32,;9.44,-10.06,;9.6,-11.57,;10.98,-12.17,;8.39,-12.45,;6.93,-13.32,;6.85,-15.01,;5.29,-15.31,;3.86,-14.71,;2.47,-16.04,;4.16,-15.66,;5.67,-16.35,;4.22,-13.91,;5.42,-12.62,;3.92,-13.08,)| Show InChI InChI=1S/C50H62N8O9/c1-29-12-6-8-16-37(29)56-49(65)52-19-11-10-18-39(46(62)55-41(27-43(59)60)48(64)58(2)42(45(51)61)25-30-13-4-3-5-14-30)54-47(63)40(26-35-28-53-38-17-9-7-15-36(35)38)57-50(66)67-44-33-21-31-20-32(23-33)24-34(44)22-31/h3-9,12-17,28,31-34,39-42,44,53H,10-11,18-27H2,1-2H3,(H2,51,61)(H,54,63)(H,55,62)(H,57,66)(H,59,60)(H2,52,56,65)/t31?,32?,33?,34?,39-,40-,41-,42-,44?/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044029 ((S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-[(S)-2-[(...) Show SMILES CN(C)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(O)=O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C43H55N9O8/c1-27-14-8-10-18-31(27)50-43(60)45-21-13-12-20-33(48-41(58)34(47-37(53)26-51(2)3)23-29-25-46-32-19-11-9-17-30(29)32)40(57)49-35(24-38(54)55)42(59)52(4)36(39(44)56)22-28-15-6-5-7-16-28/h5-11,14-19,25,33-36,46H,12-13,20-24,26H2,1-4H3,(H2,44,56)(H,47,53)(H,48,58)(H,49,57)(H,54,55)(H2,45,50,60)/t33-,34-,35-,36-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044030 ((S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-[(S)-2-[(...) Show SMILES CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCC(O)=O Show InChI InChI=1S/C43H52N8O10/c1-26-12-6-8-16-30(26)50-43(61)45-21-11-10-18-32(40(58)49-34(24-38(55)56)42(60)51(2)35(39(44)57)22-27-13-4-3-5-14-27)48-41(59)33(47-36(52)19-20-37(53)54)23-28-25-46-31-17-9-7-15-29(28)31/h3-9,12-17,25,32-35,46H,10-11,18-24H2,1-2H3,(H2,44,57)(H,47,52)(H,48,59)(H,49,58)(H,53,54)(H,55,56)(H2,45,50,61)/t32-,33-,34-,35-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50041650 (CHEMBL39310 | [1-[(S)-1-[(R)-1-((S)-1-Carbamoyl-2-...) Show SMILES Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@H]1CN([C@@H](Cc2ccccc2)C(N)=O)C(=O)C1 Show InChI InChI=1S/C43H54N8O7/c1-27-14-8-10-18-32(27)49-41(56)45-21-13-12-20-34(39(54)47-30-24-37(52)51(26-30)36(38(44)53)22-28-15-6-5-7-16-28)48-40(55)35(50-42(57)58-43(2,3)4)23-29-25-46-33-19-11-9-17-31(29)33/h5-11,14-19,25,30,34-36,46H,12-13,20-24,26H2,1-4H3,(H2,44,53)(H,47,54)(H,48,55)(H,50,57)(H2,45,49,56)/t30-,34+,35?,36+/m1/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Concentration that inhibited 50% of specific binding of [125I]-Bolton-Hunter CCK-8 binding in guinea pig pancreas				J Med Chem 37: 1562-8 (1994) BindingDB Entry DOI: 10.7270/Q2WD3ZMM
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044034 ((S)-3-[(S)-2-[(S)-2-(Adamantan-1-yloxycarbonylamin...) Show SMILES CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC12CC3CC(CC(C3)C1)C2 |TLB:60:61:65:59.58.64,THB:62:61:58:63.65.64,62:63:58:61.66.60,60:59:65:61.66.62| Show InChI InChI=1S/C50H62N8O9/c1-30-12-6-8-16-37(30)56-48(65)52-19-11-10-18-39(45(62)55-41(25-43(59)60)47(64)58(2)42(44(51)61)23-31-13-4-3-5-14-31)54-46(63)40(24-35-29-53-38-17-9-7-15-36(35)38)57-49(66)67-50-26-32-20-33(27-50)22-34(21-32)28-50/h3-9,12-17,29,32-34,39-42,53H,10-11,18-28H2,1-2H3,(H2,51,61)(H,54,63)(H,55,62)(H,57,66)(H,59,60)(H2,52,56,65)/t32?,33?,34?,39-,40-,41-,42-,50?/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50041636 (CHEMBL289804 | [1-[(S)-1-((S)-2-{[(1-Carbamoyl-2-p...) Show SMILES CN(C(Cc1ccccc1)C(N)=O)C(=O)C[C@@H]1CCCN1C(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C Show InChI InChI=1S/C46H60N8O7/c1-30-16-9-11-21-35(30)51-44(59)48-24-14-13-23-37(50-42(57)38(52-45(60)61-46(2,3)4)27-32-29-49-36-22-12-10-20-34(32)36)43(58)54-25-15-19-33(54)28-40(55)53(5)39(41(47)56)26-31-17-7-6-8-18-31/h6-12,16-18,20-22,29,33,37-39,49H,13-15,19,23-28H2,1-5H3,(H2,47,56)(H,50,57)(H,52,60)(H2,48,51,59)/t33-,37-,38?,39?/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Concentration that inhibited 50% of specific binding of [125I]-Bolton-Hunter CCK-8 binding in guinea pig pancreas				J Med Chem 37: 1562-8 (1994) BindingDB Entry DOI: 10.7270/Q2WD3ZMM
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50044026 ((S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-[(S)-2-((...) Show SMILES CN([C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1ccccc1 Show InChI InChI=1S/C47H54N8O8/c1-30-15-9-11-21-35(30)54-47(63)49-24-14-13-23-37(44(60)53-39(28-42(57)58)46(62)55(2)40(43(48)59)25-31-16-5-3-6-17-31)52-45(61)38(51-41(56)26-32-18-7-4-8-19-32)27-33-29-50-36-22-12-10-20-34(33)36/h3-12,15-22,29,37-40,50H,13-14,23-28H2,1-2H3,(H2,48,59)(H,51,56)(H,52,61)(H,53,60)(H,57,58)(H2,49,54,63)/t37-,38-,39-,40-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]Bolton-Hunter CCK-8 binding to cholecystokinin type A receptor in guinea pig pancreas				J Med Chem 37: 309-13 (1994) BindingDB Entry DOI: 10.7270/Q2445N4S
					More data for this Ligand-Target Pair

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