Compile Data Set for Download or QSAR

Found 57 hits with Last Name = 'boteju' and Initial = 'lw'   

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
Galanin receptor type 3 (Homo sapiens (Human))	BDBM50187923 (1,3-dihydro-1-phenyl-3-[[3-(trilfluoromethyl)pheny...) Show SMILES FC(F)(F)c1cccc(c1)\N=C1\C(=O)N(c2ccccc12)c1ccccc1 Show InChI InChI=1S/C21H13F3N2O/c22-21(23,24)14-7-6-8-15(13-14)25-19-17-11-4-5-12-18(17)26(20(19)27)16-9-2-1-3-10-16/h1-13H/b25-19+	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]galanin from human GAL3				J Med Chem 49: 3757-8 (2006) Article DOI: 10.1021/jm060001n BindingDB Entry DOI: 10.7270/Q2T72H2B
					More data for this Ligand-Target Pair
Galanin receptor type 3 (Homo sapiens (Human))	BDBM50189598 (1-(ethylpropyl)-3-{[3-(trifluoromethyl)phenyl]azam...) Show SMILES CCC(CC)N1C(=O)\C(=N\c2ccc(cc2)C(F)(F)F)c2ccccc12 Show InChI InChI=1S/C20H19F3N2O/c1-3-15(4-2)25-17-8-6-5-7-16(17)18(19(25)26)24-14-11-9-13(10-12-14)20(21,22)23/h5-12,15H,3-4H2,1-2H3/b24-18+	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	52	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]galanin from human GAL3				J Med Chem 49: 3757-8 (2006) Article DOI: 10.1021/jm060001n BindingDB Entry DOI: 10.7270/Q2T72H2B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 4 (Homo sapiens (Human))	BDBM50187923 (1,3-dihydro-1-phenyl-3-[[3-(trilfluoromethyl)pheny...) Show SMILES FC(F)(F)c1cccc(c1)\N=C1\C(=O)N(c2ccccc12)c1ccccc1 Show InChI InChI=1S/C21H13F3N2O/c22-21(23,24)14-7-6-8-15(13-14)25-19-17-11-4-5-12-18(17)26(20(19)27)16-9-2-1-3-10-16/h1-13H/b25-19+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	72	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human 5HT4				J Med Chem 49: 3757-8 (2006) Article DOI: 10.1021/jm060001n BindingDB Entry DOI: 10.7270/Q2T72H2B
					More data for this Ligand-Target Pair
Galanin receptor type 3 (Homo sapiens (Human))	BDBM50189596 (1-(2-propynyl)-3-{[3-(trifluoromethyl)phenyl]azame...) Show SMILES FC(F)(F)c1cccc(c1)\N=C1\C(=O)N(CC#C)c2ccccc12 Show InChI InChI=1S/C18H11F3N2O/c1-2-10-23-15-9-4-3-8-14(15)16(17(23)24)22-13-7-5-6-12(11-13)18(19,20)21/h1,3-9,11H,10H2/b22-16+	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	89	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]galanin from human GAL3				J Med Chem 49: 3757-8 (2006) Article DOI: 10.1021/jm060001n BindingDB Entry DOI: 10.7270/Q2T72H2B
					More data for this Ligand-Target Pair
Galanin receptor type 3 (Homo sapiens (Human))	BDBM50189600 ((E)-1-allyl-3-(3,4-dichlorophenylimino)indolin-2-o...) Show SMILES Clc1ccc(cc1Cl)\N=C1\C(=O)N(CC=C)c2ccccc12 Show InChI InChI=1S/C17H12Cl2N2O/c1-2-9-21-15-6-4-3-5-12(15)16(17(21)22)20-11-7-8-13(18)14(19)10-11/h2-8,10H,1,9H2/b20-16+	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	150	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]galanin from human GAL3				J Med Chem 49: 3757-8 (2006) Article DOI: 10.1021/jm060001n BindingDB Entry DOI: 10.7270/Q2T72H2B
					More data for this Ligand-Target Pair
Galanin receptor type 3 (Homo sapiens (Human))	BDBM50189597 ((E)-3-(2,3-dichlorophenylimino)indolin-2-one | CHE...) Show SMILES Clc1cccc(\N=C2\C(=O)Nc3ccccc23)c1Cl Show InChI InChI=1S/C14H8Cl2N2O/c15-9-5-3-7-11(12(9)16)17-13-8-4-1-2-6-10(8)18-14(13)19/h1-7H,(H,17,18,19)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	437	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]galanin from human GAL3				J Med Chem 49: 3757-8 (2006) Article DOI: 10.1021/jm060001n BindingDB Entry DOI: 10.7270/Q2T72H2B
					More data for this Ligand-Target Pair
Galanin receptor type 3 (Homo sapiens (Human))	BDBM50189595 (3-{[3-(trifluoromethyl)phenyl]azamethylene}benzo[d...) Show SMILES FC(F)(F)c1cccc(c1)\N=C1\C(=O)Nc2ccccc12 Show InChI InChI=1S/C15H9F3N2O/c16-15(17,18)9-4-3-5-10(8-9)19-13-11-6-1-2-7-12(11)20-14(13)21/h1-8H,(H,19,20,21)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	596	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]galanin from human GAL3				J Med Chem 49: 3757-8 (2006) Article DOI: 10.1021/jm060001n BindingDB Entry DOI: 10.7270/Q2T72H2B
					More data for this Ligand-Target Pair
Galanin receptor type 3 (Homo sapiens (Human))	BDBM50189599 ((E)-3-(4-chlorophenylimino)indolin-2-one | CHEMBL2...) Show SMILES Clc1ccc(cc1)\N=C1\C(=O)Nc2ccccc12 Show InChI InChI=1S/C14H9ClN2O/c15-9-5-7-10(8-6-9)16-13-11-3-1-2-4-12(11)17-14(13)18/h1-8H,(H,16,17,18)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	850	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]galanin from human GAL3				J Med Chem 49: 3757-8 (2006) Article DOI: 10.1021/jm060001n BindingDB Entry DOI: 10.7270/Q2T72H2B
					More data for this Ligand-Target Pair
Galanin receptor type 3 (Homo sapiens (Human))	BDBM50189601 ((E)-3-(4-methoxyphenylimino)indolin-2-one | (E/Z)-...) Show SMILES COc1ccc(cc1)\N=C1\C(=O)Nc2ccccc12 Show InChI InChI=1S/C15H12N2O2/c1-19-11-8-6-10(7-9-11)16-14-12-4-2-3-5-13(12)17-15(14)18/h2-9H,1H3,(H,16,17,18)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]galanin from human GAL3				J Med Chem 49: 3757-8 (2006) Article DOI: 10.1021/jm060001n BindingDB Entry DOI: 10.7270/Q2T72H2B
					More data for this Ligand-Target Pair
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50029748 ((2R,3R)-15-(2-Acetylamino-hexanoylamino)-9-benzyl-...) Show SMILES [H][C@]1(NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@H](CC(=O)NCCCC[C@H](NC1=O)C(N)=O)NC(=O)[C@H](CCCC)NC(C)=O)[C@@H](C)c1c[nH]c2ccccc12 |wU:27.28,56.63,65.68,5.5,wD:37.55,46.52,16.16,1.0,(19.89,-7.11,;18.68,-8.53,;18.45,-7.02,;17.78,-5.61,;19.09,-4.78,;16.79,-4.45,;17.81,-3.3,;19.32,-3.62,;20.34,-2.47,;21.85,-2.76,;22.87,-1.63,;24.37,-1.93,;22.39,-.17,;15.51,-3.6,;14.03,-3.12,;13.68,-4.91,;12.5,-3.04,;12.37,-1.5,;13.62,-.62,;13.49,.92,;14.74,1.81,;16.15,1.17,;16.27,-.36,;15.03,-1.26,;11.02,-3.39,;9.65,-4.13,;10.31,-5.51,;8.56,-5.2,;7.34,-4.26,;7.57,-2.73,;8.91,-2,;8.62,-.49,;7.12,-.27,;6.45,-1.66,;7.79,-6.54,;7.41,-8.01,;5.87,-7.85,;7.44,-9.54,;7.89,-11.05,;8.72,-12.34,;7.57,-13.33,;9.87,-13.36,;11.25,-14.03,;12.78,-14.32,;14.29,-14.18,;15.73,-13.64,;16.98,-12.71,;17.94,-11.49,;18.52,-10.06,;19.99,-10.45,;18.07,-13.81,;17.65,-15.3,;19.54,-13.43,;5.93,-9.81,;5.36,-11.25,;6.35,-12.45,;3.85,-11.49,;2.89,-10.29,;3.44,-8.87,;2.44,-7.66,;2.99,-6.22,;3.31,-12.93,;1.8,-13.27,;1.32,-14.71,;.78,-12.11,;20.21,-8.52,;20.6,-7.02,;21.56,-9.26,;23,-8.75,;23.93,-9.99,;23.03,-11.25,;23.41,-12.75,;22.26,-13.81,;20.79,-13.36,;20.47,-11.86,;21.59,-10.8,)| Show InChI InChI=1S/C51H71N15O9/c1-4-5-17-37(60-30(3)67)45(70)65-41-25-42(68)56-21-12-11-19-36(44(52)69)61-50(75)43(29(2)34-27-58-35-18-10-9-16-33(34)35)66-46(71)38(20-13-22-57-51(53)54)62-47(72)39(23-31-14-7-6-8-15-31)63-48(73)40(64-49(41)74)24-32-26-55-28-59-32/h6-10,14-16,18,26-29,36-41,43,58H,4-5,11-13,17,19-25H2,1-3H3,(H2,52,69)(H,55,59)(H,56,68)(H,60,67)(H,61,75)(H,62,72)(H,63,73)(H,64,74)(H,65,70)(H,66,71)(H4,53,54,57)/t29-,36-,37-,38-,39+,40-,41-,43-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.5	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description The concentration that inhibits 50% specific binding was determined against the Melanocortin 1 receptor				J Med Chem 38: 4720-9 (1995) BindingDB Entry DOI: 10.7270/Q2B56HRS
					More data for this Ligand-Target Pair
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50184359 ((3S,6S,9R,12S,15S,23S)-15-((S)-2-acetylamino-hexan...) Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r,wU:21.75,50.52,12.11,4.4,39.41,wD:25.25,61.64,(19.68,-11.7,;18.32,-10.97,;18.27,-9.43,;16.91,-8.71,;16.86,-7.17,;18.17,-6.36,;18.11,-4.82,;19.42,-4,;16.76,-4.09,;15.5,-6.44,;15.45,-4.9,;14.19,-7.26,;12.83,-6.53,;11.53,-7.35,;11.58,-8.88,;12.94,-9.61,;10.27,-9.7,;8.91,-8.97,;7.6,-9.79,;6.25,-9.06,;4.94,-9.87,;3.58,-9.15,;3.53,-7.61,;2.17,-6.88,;.86,-7.7,;2.12,-5.35,;.76,-4.62,;.71,-3.08,;1.93,-2.14,;1.41,-.69,;-.14,-.74,;-1.21,.35,;-2.69,-.02,;-3.1,-1.51,;-2.03,-2.6,;-.56,-2.22,;3.43,-4.53,;4.79,-5.26,;4.84,-6.8,;6.98,-5.22,;8.76,-4.36,;10.12,-5.08,;10.17,-6.62,;8.86,-7.43,;7.5,-6.71,;6.19,-7.52,;8.83,-5.93,;6.09,-4.44,;6.04,-2.9,;4.68,-2.18,;7.35,-2.09,;7.3,-.55,;5.94,.17,;5.89,1.71,;4.53,2.44,;3.23,1.62,;3.28,.07,;4.64,-.64,;8.71,-2.82,;10.02,-2,;9.96,-.46,;11.37,-2.73,;12.68,-1.91,;12.64,-.37,;13.86,.56,;13.35,2.01,;11.81,1.97,;11.37,.5,;11.42,-4.27,;12.78,-4.99,;14.09,-4.18,;2.27,-9.96,;.91,-9.24,;2.32,-11.5,)| Show InChI InChI=1S/C50H69N15O9/c1-3-4-16-36(59-29(2)66)44(69)65-41-25-42(67)55-20-11-10-18-35(43(51)68)60-47(72)39(23-31-26-57-34-17-9-8-15-33(31)34)63-45(70)37(19-12-21-56-50(52)53)61-46(71)38(22-30-13-6-5-7-14-30)62-48(73)40(64-49(41)74)24-32-27-54-28-58-32/h5-9,13-15,17,26-28,35-41,57H,3-4,10-12,16,18-25H2,1-2H3,(H2,51,68)(H,54,58)(H,55,67)(H,59,66)(H,60,72)(H,61,71)(H,62,73)(H,63,70)(H,64,74)(H,65,69)(H4,52,53,56)/t35-,36-,37-,38+,39-,40-,41-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL 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
University of Arizona Curated by ChEMBL					Assay Description The concentration that inhibits 50% specific binding was determined against the Melanocortin 1 receptor				J Med Chem 38: 4720-9 (1995) BindingDB Entry DOI: 10.7270/Q2B56HRS
					More data for this Ligand-Target Pair
Gastrin/cholecystokinin type B receptor (Homo sapiens (Human))	BDBM21146 ((3S)-3-[(2S)-2-[(2S)-2-{2-[(2R)-2-[(2S)-2-[(3S)-3-...) Show SMILES CCCC[C@H](N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C55H66N10O13/c1-3-4-19-45(54(77)64-43(29-48(70)71)53(76)61-40(49(57)72)24-32-13-7-5-8-14-32)65(2)55(78)44(27-35-30-58-39-18-12-11-17-37(35)39)60-46(67)31-59-51(74)41(25-33-15-9-6-10-16-33)63-52(75)42(26-34-20-22-36(66)23-21-34)62-50(73)38(56)28-47(68)69/h5-18,20-23,30,38,40-45,58,66H,3-4,19,24-29,31,56H2,1-2H3,(H2,57,72)(H,59,74)(H,60,67)(H,61,76)(H,62,73)(H,63,75)(H,64,77)(H,68,69)(H,70,71)/t38-,40-,41+,42-,43-,44-,45-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.790	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Cholecystokinin type B receptor was determined in guinea pig cortex using [3H]SNF8702 as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Gastrin/cholecystokinin type B receptor (Homo sapiens (Human))	BDBM50280901 ((S)-3-({1-[(S)-2-(2-Amino-acetylamino)-3-(S)-1H-in...) Show SMILES CCCC1C[C@H](N(C1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C34H43N7O7/c1-2-8-21-14-28(33(47)40-26(16-30(43)44)32(46)39-25(31(36)45)13-20-9-4-3-5-10-20)41(19-21)34(48)27(38-29(42)17-35)15-22-18-37-24-12-7-6-11-23(22)24/h3-7,9-12,18,21,25-28,37H,2,8,13-17,19,35H2,1H3,(H2,36,45)(H,38,42)(H,39,46)(H,40,47)(H,43,44)/t21?,25-,26-,27-,28-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards Cholecystokinin type B receptor in cortical membranes (CNS)				Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63
					More data for this Ligand-Target Pair
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50454019 (CHEMBL2370906) Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H]([C@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(N)=O |wU:12.11,30.30,67.70,4.3,wD:52.53,20.19,41.42,53.55,(-5.23,-3.6,;-3.9,-2.83,;-2.56,-3.6,;-1.23,-2.83,;.1,-3.6,;.1,-5.14,;-1.23,-5.91,;-2.56,-5.14,;-1.23,-7.45,;1.44,-2.83,;1.44,-1.29,;2.77,-3.6,;4.1,-2.83,;4.1,-1.29,;5.44,-.52,;6.77,-1.29,;5.44,1.02,;5.44,-3.6,;5.44,-5.14,;6.77,-2.83,;8.1,-3.6,;8.1,-5.14,;9.44,-5.91,;9.6,-7.44,;11.11,-7.76,;11.88,-6.42,;10.85,-5.28,;9.44,-2.83,;9.44,-1.29,;10.77,-3.6,;12.11,-2.83,;12.11,-1.29,;13.44,-.52,;14.77,-1.29,;16.11,-.52,;16.11,1.02,;14.77,1.79,;13.44,1.02,;13.44,-3.6,;13.44,-5.14,;14.77,-2.83,;16.11,-3.6,;16.11,-5.14,;14.77,-5.91,;14.77,-7.45,;13.44,-8.22,;13.44,-9.76,;12.11,-10.53,;14.77,-10.53,;17.44,-2.83,;17.44,-1.29,;18.77,-3.6,;20.11,-2.83,;20.11,-1.29,;18.77,-.52,;21.44,-.52,;22.85,-1.14,;23.88,0,;23.11,1.34,;23.58,2.8,;22.55,3.94,;21.05,3.62,;20.57,2.16,;21.6,1.02,;21.44,-3.6,;21.44,-5.14,;22.78,-2.83,;24.11,-3.6,;25.44,-2.83,;26.78,-3.6,;28.11,-2.83,;29.44,-3.6,;30.78,-2.83,;24.11,-5.14,;22.78,-5.91,;25.44,-5.91,)| Show InChI InChI=1S/C51H73N15O10/c1-4-5-17-37(60-30(3)67)45(71)65-41(25-42(68)69)49(75)64-40(24-32-26-56-28-59-32)48(74)63-39(23-31-14-7-6-8-15-31)47(73)62-38(20-13-22-57-51(54)55)46(72)66-43(50(76)61-36(44(53)70)19-11-12-21-52)29(2)34-27-58-35-18-10-9-16-33(34)35/h6-10,14-16,18,26-29,36-41,43,58H,4-5,11-13,17,19-25,52H2,1-3H3,(H2,53,70)(H,56,59)(H,60,67)(H,61,76)(H,62,73)(H,63,74)(H,64,75)(H,65,71)(H,66,72)(H,68,69)(H4,54,55,57)/t29-,36+,37+,38+,39+,40+,41+,43-/m1/s1	PDB KEGG UniProtKB/SwissProt 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
University of Arizona Curated by ChEMBL					Assay Description The concentration that inhibits 50% specific binding was determined against the Melanocortin 1 receptor				J Med Chem 38: 4720-9 (1995) BindingDB Entry DOI: 10.7270/Q2B56HRS
					More data for this Ligand-Target Pair
Gastrin/cholecystokinin type B receptor (Homo sapiens (Human))	BDBM50092394 ((S)-3-((S)-2-{[(S)-2-(2-Amino-acetylamino)-3-(S)-1...) Show SMILES CCCC[C@H](N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C33H43N7O7/c1-3-4-14-27(40(2)33(47)26(37-28(41)18-34)16-21-19-36-23-13-9-8-12-22(21)23)32(46)39-25(17-29(42)43)31(45)38-24(30(35)44)15-20-10-6-5-7-11-20/h5-13,19,24-27,36H,3-4,14-18,34H2,1-2H3,(H2,35,44)(H,37,41)(H,38,45)(H,39,46)(H,42,43)/t24-,25-,26-,27-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	3.30	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards Cholecystokinin type B receptor in cortical membranes (CNS)				Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50001683 (13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...) Show SMILES CC1(C)SSC(C)(C)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H]1C(O)=O Show InChI InChI=1S/C30H39N5O7S2/c1-29(2)23(34-25(38)20(31)14-18-10-12-19(36)13-11-18)27(40)32-16-22(37)33-21(15-17-8-6-5-7-9-17)26(39)35-24(28(41)42)30(3,4)44-43-29/h5-13,20-21,23-24,36H,14-16,31H2,1-4H3,(H,32,40)(H,33,37)(H,34,38)(H,35,39)(H,41,42)/t20-,21+,23-,24-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor delta 1 was determined in guinea pig wholebrain using [3H][4''-Cl-Phe4]-DPDPE as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM21146 ((3S)-3-[(2S)-2-[(2S)-2-{2-[(2R)-2-[(2S)-2-[(3S)-3-...) Show SMILES CCCC[C@H](N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C55H66N10O13/c1-3-4-19-45(54(77)64-43(29-48(70)71)53(76)61-40(49(57)72)24-32-13-7-5-8-14-32)65(2)55(78)44(27-35-30-58-39-18-12-11-17-37(35)39)60-46(67)31-59-51(74)41(25-33-15-9-6-10-16-33)63-52(75)42(26-34-20-22-36(66)23-21-34)62-50(73)38(56)28-47(68)69/h5-18,20-23,30,38,40-45,58,66H,3-4,19,24-29,31,56H2,1-2H3,(H2,57,72)(H,59,74)(H,60,67)(H,61,76)(H,62,73)(H,63,75)(H,64,77)(H,68,69)(H,70,71)/t38-,40-,41+,42-,43-,44-,45-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor delta 1 was determined in guinea pig wholebrain using [3H][4''-Cl-Phe4]-DPDPE as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Homo sapiens (Human))	BDBM50280900 (3-((S)-2-{5-[(S)-1-tert-Butoxycarbonylamino-2-(1H-...) Show SMILES CCCC[C@@H](C(=O)N[C@@H](CC(=O)OCc1ccccc1)[C@@H](Cc1ccccc1)C(N)=O)n1nnnc1[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C Show InChI InChI=1S/C41H50N8O6/c1-5-6-21-35(49-38(46-47-48-49)34(45-40(53)55-41(2,3)4)23-29-25-43-32-20-14-13-19-30(29)32)39(52)44-33(24-36(50)54-26-28-17-11-8-12-18-28)31(37(42)51)22-27-15-9-7-10-16-27/h7-20,25,31,33-35,43H,5-6,21-24,26H2,1-4H3,(H2,42,51)(H,44,52)(H,45,53)/t31-,33+,34+,35+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards Cholecystokinin type A receptor in pancreatic membranes				Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50422178 (CHEMBL2112688) Show SMILES CCCC[C@H](N(C)C(=O)[C@@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39+,41+,42-,43+,44+,45+,49+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor delta 1 was determined in guinea pig wholebrain using [3H][4''-Cl-Phe4]-DPDPE as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Gastrin/cholecystokinin type B receptor (Homo sapiens (Human))	BDBM50422175 (CHEMBL2112689) Show SMILES CCCC[C@H](N(C)C(=O)[C@@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39-,41-,42+,43-,44-,45-,49-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	88	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Cholecystokinin type B receptor was determined in guinea pig cortex using [3H]SNF8702 as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50422175 (CHEMBL2112689) Show SMILES CCCC[C@H](N(C)C(=O)[C@@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39-,41-,42+,43-,44-,45-,49-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor delta 1 was determined in guinea pig wholebrain using [3H][4''-Cl-Phe4]-DPDPE as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Gastrin/cholecystokinin type B receptor (Homo sapiens (Human))	BDBM50280904 ((S)-3-{(S)-2-[(S)-2-(2-Amino-acetylamino)-3-(S)-1H...) Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C32H41N7O7/c1-2-3-12-23(37-31(45)25(36-27(40)17-33)15-20-18-35-22-13-8-7-11-21(20)22)30(44)39-26(16-28(41)42)32(46)38-24(29(34)43)14-19-9-5-4-6-10-19/h4-11,13,18,23-26,35H,2-3,12,14-17,33H2,1H3,(H2,34,43)(H,36,40)(H,37,45)(H,38,46)(H,39,44)(H,41,42)/t23-,24-,25-,26-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	169	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards Cholecystokinin type B receptor in cortical membranes (CNS)				Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Homo sapiens (Human))	BDBM50280903 (3-((S)-2-{5-[(S)-1-(2-tert-Butoxycarbonylamino-ace...) Show SMILES CCCC[C@@H](C(=O)N[C@@H](CC(=O)OCc1ccccc1)[C@@H](Cc1ccccc1)C(N)=O)n1nnnc1[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)OC(C)(C)C Show InChI InChI=1S/C43H53N9O7/c1-5-6-21-36(41(56)48-34(24-38(54)58-27-29-17-11-8-12-18-29)32(39(44)55)22-28-15-9-7-10-16-28)52-40(49-50-51-52)35(23-30-25-45-33-20-14-13-19-31(30)33)47-37(53)26-46-42(57)59-43(2,3)4/h7-20,25,32,34-36,45H,5-6,21-24,26-27H2,1-4H3,(H2,44,55)(H,46,57)(H,47,53)(H,48,56)/t32-,34+,35+,36+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	364	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards Cholecystokinin type A receptor in pancreatic membranes				Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM21146 ((3S)-3-[(2S)-2-[(2S)-2-{2-[(2R)-2-[(2S)-2-[(3S)-3-...) Show SMILES CCCC[C@H](N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C55H66N10O13/c1-3-4-19-45(54(77)64-43(29-48(70)71)53(76)61-40(49(57)72)24-32-13-7-5-8-14-32)65(2)55(78)44(27-35-30-58-39-18-12-11-17-37(35)39)60-46(67)31-59-51(74)41(25-33-15-9-6-10-16-33)63-52(75)42(26-34-20-22-36(66)23-21-34)62-50(73)38(56)28-47(68)69/h5-18,20-23,30,38,40-45,58,66H,3-4,19,24-29,31,56H2,1-2H3,(H2,57,72)(H,59,74)(H,60,67)(H,61,76)(H,62,73)(H,63,75)(H,64,77)(H,68,69)(H,70,71)/t38-,40-,41+,42-,43-,44-,45-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor mu 1 was determined in guinea pig wholebrain using [3H]CTOP radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50422177 (CHEMBL2111881) Show SMILES CCCC[C@H](N(C)C(=O)[C@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39+,41+,42-,43+,44+,45+,49-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	820	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor delta 1 was determined in guinea pig wholebrain using [3H][4''-Cl-Phe4]-DPDPE as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50422178 (CHEMBL2112688) Show SMILES CCCC[C@H](N(C)C(=O)[C@@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39+,41+,42-,43+,44+,45+,49+/m1/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Cholecystokinin type A receptor was determined in guinea pig pancreatic membranes using [125I]-BH-CCK-8 as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50422176 (CHEMBL2111882) Show SMILES CCCC[C@H](N(C)C(=O)[C@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39-,41-,42+,43-,44-,45-,49+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.05E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor delta 1 was determined in guinea pig wholebrain using [3H][4''-Cl-Phe4]-DPDPE as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50422175 (CHEMBL2112689) Show SMILES CCCC[C@H](N(C)C(=O)[C@@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39-,41-,42+,43-,44-,45-,49-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Cholecystokinin type A receptor was determined in guinea pig pancreatic membranes using [125I]-BH-CCK-8 as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Gastrin/cholecystokinin type B receptor (Homo sapiens (Human))	BDBM50280900 (3-((S)-2-{5-[(S)-1-tert-Butoxycarbonylamino-2-(1H-...) Show SMILES CCCC[C@@H](C(=O)N[C@@H](CC(=O)OCc1ccccc1)[C@@H](Cc1ccccc1)C(N)=O)n1nnnc1[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C Show InChI InChI=1S/C41H50N8O6/c1-5-6-21-35(49-38(46-47-48-49)34(45-40(53)55-41(2,3)4)23-29-25-43-32-20-14-13-19-30(29)32)39(52)44-33(24-36(50)54-26-28-17-11-8-12-18-28)31(37(42)51)22-27-15-9-7-10-16-27/h7-20,25,31,33-35,43H,5-6,21-24,26H2,1-4H3,(H2,42,51)(H,44,52)(H,45,53)/t31-,33+,34+,35+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.88E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards Cholecystokinin type B receptor in cortical membranes (CNS)				Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63
					More data for this Ligand-Target Pair
Gastrin/cholecystokinin type B receptor (Homo sapiens (Human))	BDBM50422178 (CHEMBL2112688) Show SMILES CCCC[C@H](N(C)C(=O)[C@@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39+,41+,42-,43+,44+,45+,49+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Cholecystokinin type B receptor was determined in guinea pig cortex using [3H]SNF8702 as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Homo sapiens (Human))	BDBM50280904 ((S)-3-{(S)-2-[(S)-2-(2-Amino-acetylamino)-3-(S)-1H...) Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C32H41N7O7/c1-2-3-12-23(37-31(45)25(36-27(40)17-33)15-20-18-35-22-13-8-7-11-21(20)22)30(44)39-26(16-28(41)42)32(46)38-24(29(34)43)14-19-9-5-4-6-10-19/h4-11,13,18,23-26,35H,2-3,12,14-17,33H2,1H3,(H2,34,43)(H,36,40)(H,37,45)(H,38,46)(H,39,44)(H,41,42)/t23-,24-,25-,26-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.18E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards Cholecystokinin type A receptor in pancreatic membranes				Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Homo sapiens (Human))	BDBM50280901 ((S)-3-({1-[(S)-2-(2-Amino-acetylamino)-3-(S)-1H-in...) Show SMILES CCCC1C[C@H](N(C1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C34H43N7O7/c1-2-8-21-14-28(33(47)40-26(16-30(43)44)32(46)39-25(31(36)45)13-20-9-4-3-5-10-20)41(19-21)34(48)27(38-29(42)17-35)15-22-18-37-24-12-7-6-11-23(22)24/h3-7,9-12,18,21,25-28,37H,2,8,13-17,19,35H2,1H3,(H2,36,45)(H,38,42)(H,39,46)(H,40,47)(H,43,44)/t21?,25-,26-,27-,28-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards Cholecystokinin type A receptor in pancreatic membranes				Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50422178 (CHEMBL2112688) Show SMILES CCCC[C@H](N(C)C(=O)[C@@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39+,41+,42-,43+,44+,45+,49+/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.05E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor mu 1 was determined in guinea pig wholebrain using [3H]CTOP radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Gastrin/cholecystokinin type B receptor (Homo sapiens (Human))	BDBM50280903 (3-((S)-2-{5-[(S)-1-(2-tert-Butoxycarbonylamino-ace...) Show SMILES CCCC[C@@H](C(=O)N[C@@H](CC(=O)OCc1ccccc1)[C@@H](Cc1ccccc1)C(N)=O)n1nnnc1[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)OC(C)(C)C Show InChI InChI=1S/C43H53N9O7/c1-5-6-21-36(41(56)48-34(24-38(54)58-27-29-17-11-8-12-18-29)32(39(44)55)22-28-15-9-7-10-16-28)52-40(49-50-51-52)35(23-30-25-45-33-20-14-13-19-31(30)33)47-37(53)26-46-42(57)59-43(2,3)4/h7-20,25,32,34-36,45H,5-6,21-24,26-27H2,1-4H3,(H2,44,55)(H,46,57)(H,47,53)(H,48,56)/t32-,34+,35+,36+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	4.25E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards Cholecystokinin type B receptor in cortical membranes (CNS)				Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63
					More data for this Ligand-Target Pair
Gastrin/cholecystokinin type B receptor (Homo sapiens (Human))	BDBM50280898 ((3S,4R)-3-((S)-2-{5-[(S)-1-(2-Amino-acetylamino)-2...) Show SMILES CCCC[C@@H](C(=O)N[C@@H](CC(O)=O)[C@@H](Cc1ccccc1)C(N)=O)n1nnnc1[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN Show InChI InChI=1S/C31H39N9O5/c1-2-3-13-26(31(45)36-24(16-28(42)43)22(29(33)44)14-19-9-5-4-6-10-19)40-30(37-38-39-40)25(35-27(41)17-32)15-20-18-34-23-12-8-7-11-21(20)23/h4-12,18,22,24-26,34H,2-3,13-17,32H2,1H3,(H2,33,44)(H,35,41)(H,36,45)(H,42,43)/t22-,24+,25+,26+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	4.53E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards Cholecystokinin type B receptor in cortical membranes (CNS)				Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63
					More data for this Ligand-Target Pair
Gastrin/cholecystokinin type B receptor (Homo sapiens (Human))	BDBM50422177 (CHEMBL2111881) Show SMILES CCCC[C@H](N(C)C(=O)[C@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39+,41+,42-,43+,44+,45+,49-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Cholecystokinin type B receptor was determined in guinea pig cortex using [3H]SNF8702 as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Gastrin/cholecystokinin type B receptor (Homo sapiens (Human))	BDBM50422176 (CHEMBL2111882) Show SMILES CCCC[C@H](N(C)C(=O)[C@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39-,41-,42+,43-,44-,45-,49+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Cholecystokinin type B receptor was determined in guinea pig cortex using [3H]SNF8702 as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50422175 (CHEMBL2112689) Show SMILES CCCC[C@H](N(C)C(=O)[C@@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39-,41-,42+,43-,44-,45-,49-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor mu 1 was determined in guinea pig wholebrain using [3H]CTOP radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50001683 (13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...) Show SMILES CC1(C)SSC(C)(C)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H]1C(O)=O Show InChI InChI=1S/C30H39N5O7S2/c1-29(2)23(34-25(38)20(31)14-18-10-12-19(36)13-11-18)27(40)32-16-22(37)33-21(15-17-8-6-5-7-9-17)26(39)35-24(28(41)42)30(3,4)44-43-29/h5-13,20-21,23-24,36H,14-16,31H2,1-4H3,(H,32,40)(H,33,37)(H,34,38)(H,35,39)(H,41,42)/t20-,21+,23-,24-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor mu 1 was determined in guinea pig wholebrain using [3H]CTOP radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50422177 (CHEMBL2111881) Show SMILES CCCC[C@H](N(C)C(=O)[C@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39+,41+,42-,43+,44+,45+,49-/m1/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Cholecystokinin type A receptor was determined in guinea pig pancreatic membranes using [125I]-BH-CCK-8 as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50422176 (CHEMBL2111882) Show SMILES CCCC[C@H](N(C)C(=O)[C@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39-,41-,42+,43-,44-,45-,49+/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Cholecystokinin type A receptor was determined in guinea pig pancreatic membranes using [125I]-BH-CCK-8 as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Gastrin/cholecystokinin type B receptor (Homo sapiens (Human))	BDBM50280899 ((S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-{(S)-2-[3...) Show SMILES CCCC[C@H](N=CC[C@H](Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |w:6.6| Show InChI InChI=1S/C38H49N5O7/c1-5-6-16-30(35(47)43-32(24-33(44)45)36(48)42-31(34(39)46)23-25-12-8-7-9-13-25)40-20-19-29(41-37(49)50-38(2,3)4)22-26-17-18-27-14-10-11-15-28(27)21-26/h7-15,17-18,20-21,29-32H,5-6,16,19,22-24H2,1-4H3,(H2,39,46)(H,41,49)(H,42,48)(H,43,47)(H,44,45)/t29-,30+,31+,32+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards Cholecystokinin type B receptor in cortical membranes (CNS)				Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63
					More data for this Ligand-Target Pair
Gastrin/cholecystokinin type B receptor (Homo sapiens (Human))	BDBM50280902 (3-{2-Benzyloxycarbonylamino-2-[1-(1-benzyloxycarbo...) Show SMILES CCCCC(C(=O)OCc1ccccc1)n1nnnc1C(Cc1cn(C(=O)OCc2ccccc2)c2ccccc12)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C40H40N6O6/c1-2-3-22-36(38(47)50-26-29-15-7-4-8-16-29)46-37(42-43-44-46)34(41-39(48)51-27-30-17-9-5-10-18-30)24-32-25-45(35-23-14-13-21-33(32)35)40(49)52-28-31-19-11-6-12-20-31/h4-21,23,25,34,36H,2-3,22,24,26-28H2,1H3,(H,41,48)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards Cholecystokinin type B receptor in cortical membranes (CNS)				Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Homo sapiens (Human))	BDBM50092394 ((S)-3-((S)-2-{[(S)-2-(2-Amino-acetylamino)-3-(S)-1...) Show SMILES CCCC[C@H](N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C33H43N7O7/c1-3-4-14-27(40(2)33(47)26(37-28(41)18-34)16-21-19-36-23-13-9-8-12-22(21)23)32(46)39-25(17-29(42)43)31(45)38-24(30(35)44)15-20-10-6-5-7-11-20/h5-13,19,24-27,36H,3-4,14-18,34H2,1-2H3,(H2,35,44)(H,37,41)(H,38,45)(H,39,46)(H,42,43)/t24-,25-,26-,27-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards Cholecystokinin type A receptor in pancreatic membranes				Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Homo sapiens (Human))	BDBM50280902 (3-{2-Benzyloxycarbonylamino-2-[1-(1-benzyloxycarbo...) Show SMILES CCCCC(C(=O)OCc1ccccc1)n1nnnc1C(Cc1cn(C(=O)OCc2ccccc2)c2ccccc12)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C40H40N6O6/c1-2-3-22-36(38(47)50-26-29-15-7-4-8-16-29)46-37(42-43-44-46)34(41-39(48)51-27-30-17-9-5-10-18-30)24-32-25-45(35-23-14-13-21-33(32)35)40(49)52-28-31-19-11-6-12-20-31/h4-21,23,25,34,36H,2-3,22,24,26-28H2,1H3,(H,41,48)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards Cholecystokinin type A receptor in pancreatic membranes				Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Homo sapiens (Human))	BDBM50280898 ((3S,4R)-3-((S)-2-{5-[(S)-1-(2-Amino-acetylamino)-2...) Show SMILES CCCC[C@@H](C(=O)N[C@@H](CC(O)=O)[C@@H](Cc1ccccc1)C(N)=O)n1nnnc1[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN Show InChI InChI=1S/C31H39N9O5/c1-2-3-13-26(31(45)36-24(16-28(42)43)22(29(33)44)14-19-9-5-4-6-10-19)40-30(37-38-39-40)25(35-27(41)17-32)15-20-18-34-23-12-8-7-11-21(20)23/h4-12,18,22,24-26,34H,2-3,13-17,32H2,1H3,(H2,33,44)(H,35,41)(H,36,45)(H,42,43)/t22-,24+,25+,26+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards Cholecystokinin type A receptor in pancreatic membranes				Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM21146 ((3S)-3-[(2S)-2-[(2S)-2-{2-[(2R)-2-[(2S)-2-[(3S)-3-...) Show SMILES CCCC[C@H](N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C55H66N10O13/c1-3-4-19-45(54(77)64-43(29-48(70)71)53(76)61-40(49(57)72)24-32-13-7-5-8-14-32)65(2)55(78)44(27-35-30-58-39-18-12-11-17-37(35)39)60-46(67)31-59-51(74)41(25-33-15-9-6-10-16-33)63-52(75)42(26-34-20-22-36(66)23-21-34)62-50(73)38(56)28-47(68)69/h5-18,20-23,30,38,40-45,58,66H,3-4,19,24-29,31,56H2,1-2H3,(H2,57,72)(H,59,74)(H,60,67)(H,61,76)(H,62,73)(H,63,75)(H,64,77)(H,68,69)(H,70,71)/t38-,40-,41+,42-,43-,44-,45-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Cholecystokinin type A receptor was determined in guinea pig pancreatic membranes using [125I]-BH-CCK-8 as radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50422177 (CHEMBL2111881) Show SMILES CCCC[C@H](N(C)C(=O)[C@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39+,41+,42-,43+,44+,45+,49-/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor mu 1 was determined in guinea pig wholebrain using [3H]CTOP radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50422176 (CHEMBL2111882) Show SMILES CCCC[C@H](N(C)C(=O)[C@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)[C@@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C56H68N10O13/c1-4-5-20-45(55(78)64-44(29-48(71)72)54(77)61-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)49(32(2)38-30-59-40-19-13-12-18-37(38)40)65-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)63-53(76)43(27-35-21-23-36(67)24-22-35)62-51(74)39(57)28-47(69)70/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,77)(H,62,74)(H,63,76)(H,64,78)(H,65,68)(H,69,70)(H,71,72)/t32-,39-,41-,42+,43-,44-,45-,49+/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor mu 1 was determined in guinea pig wholebrain using [3H]CTOP radioligand				J Med Chem 39: 4120-4 (1996) Article DOI: 10.1021/jm960078j BindingDB Entry DOI: 10.7270/Q2P55P5Z
					More data for this Ligand-Target Pair
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50184359 ((3S,6S,9R,12S,15S,23S)-15-((S)-2-acetylamino-hexan...) Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r,wU:21.75,50.52,12.11,4.4,39.41,wD:25.25,61.64,(19.68,-11.7,;18.32,-10.97,;18.27,-9.43,;16.91,-8.71,;16.86,-7.17,;18.17,-6.36,;18.11,-4.82,;19.42,-4,;16.76,-4.09,;15.5,-6.44,;15.45,-4.9,;14.19,-7.26,;12.83,-6.53,;11.53,-7.35,;11.58,-8.88,;12.94,-9.61,;10.27,-9.7,;8.91,-8.97,;7.6,-9.79,;6.25,-9.06,;4.94,-9.87,;3.58,-9.15,;3.53,-7.61,;2.17,-6.88,;.86,-7.7,;2.12,-5.35,;.76,-4.62,;.71,-3.08,;1.93,-2.14,;1.41,-.69,;-.14,-.74,;-1.21,.35,;-2.69,-.02,;-3.1,-1.51,;-2.03,-2.6,;-.56,-2.22,;3.43,-4.53,;4.79,-5.26,;4.84,-6.8,;6.98,-5.22,;8.76,-4.36,;10.12,-5.08,;10.17,-6.62,;8.86,-7.43,;7.5,-6.71,;6.19,-7.52,;8.83,-5.93,;6.09,-4.44,;6.04,-2.9,;4.68,-2.18,;7.35,-2.09,;7.3,-.55,;5.94,.17,;5.89,1.71,;4.53,2.44,;3.23,1.62,;3.28,.07,;4.64,-.64,;8.71,-2.82,;10.02,-2,;9.96,-.46,;11.37,-2.73,;12.68,-1.91,;12.64,-.37,;13.86,.56,;13.35,2.01,;11.81,1.97,;11.37,.5,;11.42,-4.27,;12.78,-4.99,;14.09,-4.18,;2.27,-9.96,;.91,-9.24,;2.32,-11.5,)| Show InChI InChI=1S/C50H69N15O9/c1-3-4-16-36(59-29(2)66)44(69)65-41-25-42(67)55-20-11-10-18-35(43(51)68)60-47(72)39(23-31-26-57-34-17-9-8-15-33(31)34)63-45(70)37(19-12-21-56-50(52)53)61-46(71)38(22-30-13-6-5-7-14-30)62-48(73)40(64-49(41)74)24-32-27-54-28-58-32/h5-9,13-15,17,26-28,35-41,57H,3-4,10-12,16,18-25H2,1-2H3,(H2,51,68)(H,54,58)(H,55,67)(H,59,66)(H,60,72)(H,61,71)(H,62,73)(H,63,70)(H,64,74)(H,65,69)(H4,52,53,56)/t35-,36-,37-,38+,39-,40-,41-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	0.150	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Effective concentration against Melanocortin 1 receptor transfected into L-cells was determined by concentration of peptide for 50% maximal cAMP gene...				J Med Chem 38: 4720-9 (1995) BindingDB Entry DOI: 10.7270/Q2B56HRS
					More data for this Ligand-Target Pair

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