Compile Data Set for Download or QSAR

Found 85 hits with Last Name = 'merz' and Initial = 'h'   

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
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059767 ((2R,6S,11R)-3-((S)-2-Methoxy-propyl)-6,11-dimethyl...) Show SMILES CO[C@@H](C)CN1CC[C@@]2(C)[C@@H](C)[C@H]1Cc1ccc(O)cc21 |THB:4:5:10:20.14.13| Show InChI InChI=1S/C18H27NO2/c1-12(21-4)11-19-8-7-18(3)13(2)17(19)9-14-5-6-15(20)10-16(14)18/h5-6,10,12-13,17,20H,7-9,11H2,1-4H3/t12-,13-,17+,18-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059778 ((2R,6S)-3-((S)-2-Methoxy-propyl)-6,11,11-trimethyl...) Show SMILES CO[C@@H](C)CN1CC[C@@]2(C)c3cc(O)ccc3C[C@@H]1C2(C)C |TLB:4:5:19:10.16.17| Show InChI InChI=1S/C19H29NO2/c1-13(22-5)12-20-9-8-19(4)16-11-15(21)7-6-14(16)10-17(20)18(19,2)3/h6-7,11,13,17,21H,8-10,12H2,1-5H3/t13-,17+,19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059761 ((2R,6S,11R)-6,11-Dimethyl-3-((S)-2-methylsulfanyl-...) Show SMILES CS[C@@H](C)CN1CC[C@@]2(C)[C@@H](C)[C@H]1Cc1ccc(O)cc21 |THB:4:5:10:20.14.13| Show InChI InChI=1S/C18H27NOS/c1-12(21-4)11-19-8-7-18(3)13(2)17(19)9-14-5-6-15(20)10-16(14)18/h5-6,10,12-13,17,20H,7-9,11H2,1-4H3/t12-,13-,17+,18-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059772 ((2R,6S,11S)-3-((S)-2-Methoxy-propyl)-6,11-dimethyl...) Show SMILES CO[C@@H](C)CN1CC[C@@]2(C)[C@H](C)[C@H]1Cc1ccc(O)cc21 |THB:4:5:10:20.14.13| Show InChI InChI=1S/C18H27NO2/c1-12(21-4)11-19-8-7-18(3)13(2)17(19)9-14-5-6-15(20)10-16(14)18/h5-6,10,12-13,17,20H,7-9,11H2,1-4H3/t12-,13+,17+,18-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059764 ((2R,6S,11R)-3-(2-Methoxy-2-methyl-propyl)-6,11-dim...) Show SMILES COC(C)(C)CN1CC[C@@]2(C)[C@@H](C)[C@H]1Cc1ccc(O)cc21 |THB:5:6:11:21.15.14| Show InChI InChI=1S/C19H29NO2/c1-13-17-10-14-6-7-15(21)11-16(14)19(13,4)8-9-20(17)12-18(2,3)22-5/h6-7,11,13,17,21H,8-10,12H2,1-5H3/t13-,17+,19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059786 ((2R,6S,11R)-6,11-Dimethyl-3-((R)-2-methylsulfanyl-...) Show SMILES CS[C@H](C)CN1CC[C@@]2(C)[C@@H](C)[C@H]1Cc1ccc(O)cc21 |THB:4:5:10:20.14.13| Show InChI InChI=1S/C18H27NOS/c1-12(21-4)11-19-8-7-18(3)13(2)17(19)9-14-5-6-15(20)10-16(14)18/h5-6,10,12-13,17,20H,7-9,11H2,1-4H3/t12-,13+,17-,18+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059800 ((2R,6S)-3-((S)-2-Methoxy-propyl)-6,11,11-trimethyl...) Show SMILES CO[C@@H](C)CN1CC[C@@]2(C)c3ccc(O)cc3C[C@@H]1C2(C)C |TLB:4:5:19:10.16.17| Show InChI InChI=1S/C19H29NO2/c1-13(22-5)12-20-9-8-19(4)16-7-6-15(21)10-14(16)11-17(20)18(19,2)3/h6-7,10,13,17,21H,8-9,11-12H2,1-5H3/t13-,17+,19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	18.2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059794 ((2R,6R)-3-((S)-2-Methoxy-propyl)-6,11,11-trimethyl...) Show SMILES CO[C@@H](C)CN1CC[C@@]2(C)c3c(O)cccc3C[C@@H]1C2(C)C |TLB:4:5:19:10.16.17| Show InChI InChI=1S/C19H29NO2/c1-13(22-5)12-20-10-9-19(4)17-14(7-6-8-15(17)21)11-16(20)18(19,2)3/h6-8,13,16,21H,9-12H2,1-5H3/t13-,16+,19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	20.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059803 ((2R,6S,11S)-6,11-Dimethyl-3-((S)-2-methylsulfanyl-...) Show SMILES CS[C@@H](C)CN1CC[C@@]2(C)[C@H](C)[C@H]1Cc1ccc(O)cc21 |THB:4:5:10:20.14.13| Show InChI InChI=1S/C18H27NOS/c1-12(21-4)11-19-8-7-18(3)13(2)17(19)9-14-5-6-15(20)10-16(14)18/h5-6,10,12-13,17,20H,7-9,11H2,1-4H3/t12-,13+,17+,18-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	97	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059783 ((2R,6S)-3-((R)-2-Methoxy-propyl)-6,11,11-trimethyl...) Show SMILES CO[C@H](C)CN1CC[C@@]2(C)c3cc(O)ccc3C[C@@H]1C2(C)C |TLB:4:5:19:10.16.17| Show InChI InChI=1S/C19H29NO2/c1-13(22-5)12-20-9-8-19(4)16-11-15(21)7-6-14(16)10-17(20)18(19,2)3/h6-7,11,13,17,21H,8-10,12H2,1-5H3/t13-,17-,19+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	108	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059788 ((2R,6S)-3-((S)-2-Methoxy-propyl)-6,11,11-trimethyl...) Show SMILES CO[C@@H](C)CN1CC[C@@]2(C)c3ccccc3C[C@@H]1C2(C)C |TLB:4:5:18:10.16.15| Show InChI InChI=1S/C19H29NO/c1-14(21-5)13-20-11-10-19(4)16-9-7-6-8-15(16)12-17(20)18(19,2)3/h6-9,14,17H,10-13H2,1-5H3/t14-,17+,19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	144	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059766 ((2R,6S,11R)-3-((R)-2-Methoxy-propyl)-6,11-dimethyl...) Show SMILES CO[C@H](C)CN1CC[C@@]2(C)[C@@H](C)[C@H]1Cc1ccc(O)cc21 |THB:4:5:10:20.14.13| Show InChI InChI=1S/C18H27NO2/c1-12(21-4)11-19-8-7-18(3)13(2)17(19)9-14-5-6-15(20)10-16(14)18/h5-6,10,12-13,17,20H,7-9,11H2,1-4H3/t12-,13+,17-,18+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	146	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059792 ((2R,6S,11S)-3-((R)-2-Methoxy-propyl)-6,11-dimethyl...) Show SMILES CO[C@H](C)CN1CC[C@@]2(C)[C@H](C)[C@H]1Cc1ccc(O)cc21 |THB:4:5:10:20.14.13| Show InChI InChI=1S/C18H27NO2/c1-12(21-4)11-19-8-7-18(3)13(2)17(19)9-14-5-6-15(20)10-16(14)18/h5-6,10,12-13,17,20H,7-9,11H2,1-4H3/t12-,13-,17-,18+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	212	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059797 ((2R,6S,11S)-6,11-Dimethyl-3-((R)-2-methylsulfanyl-...) Show SMILES CS[C@H](C)CN1CC[C@@]2(C)[C@H](C)[C@H]1Cc1ccc(O)cc21 |THB:4:5:10:20.14.13| Show InChI InChI=1S/C18H27NOS/c1-12(21-4)11-19-8-7-18(3)13(2)17(19)9-14-5-6-15(20)10-16(14)18/h5-6,10,12-13,17,20H,7-9,11H2,1-4H3/t12-,13-,17-,18+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	236	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059771 ((2S,6R)-3-((S)-2-Methoxy-propyl)-6,11,11-trimethyl...) Show SMILES CO[C@@H](C)CN1CC[C@]2(C)c3ccc(O)cc3C[C@H]1C2(C)C |TLB:4:5:19:10.16.17| Show InChI InChI=1S/C19H29NO2/c1-13(22-5)12-20-9-8-19(4)16-7-6-15(21)10-14(16)11-17(20)18(19,2)3/h6-7,10,13,17,21H,8-9,11-12H2,1-5H3/t13-,17-,19+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.34E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059777 ((2R,6S)-3-((R)-2-Methoxy-propyl)-6,11,11-trimethyl...) Show SMILES CO[C@H](C)CN1CC[C@@]2(C)c3ccc(O)cc3C[C@@H]1C2(C)C |TLB:4:5:19:10.16.17| Show InChI InChI=1S/C19H29NO2/c1-13(22-5)12-20-9-8-19(4)16-7-6-15(21)10-14(16)11-17(20)18(19,2)3/h6-7,10,13,17,21H,8-9,11-12H2,1-5H3/t13-,17-,19+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059782 ((2S,6R,11S)-3-((S)-2-Methoxy-propyl)-6,11-dimethyl...) Show SMILES CO[C@@H](C)CN1CC[C@]2(C)[C@H](C)[C@@H]1Cc1ccc(O)cc21 |THB:4:5:10:20.14.13| Show InChI InChI=1S/C18H27NO2/c1-12(21-4)11-19-8-7-18(3)13(2)17(19)9-14-5-6-15(20)10-16(14)18/h5-6,10,12-13,17,20H,7-9,11H2,1-4H3/t12-,13+,17-,18+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059759 ((2S,6R)-3-((S)-2-Methoxy-propyl)-6,11,11-trimethyl...) Show SMILES CO[C@@H](C)CN1CC[C@]2(C)c3cc(O)ccc3C[C@H]1C2(C)C |TLB:4:5:19:10.16.17| Show InChI InChI=1S/C19H29NO2/c1-13(22-5)12-20-9-8-19(4)16-11-15(21)7-6-14(16)10-17(20)18(19,2)3/h6-7,11,13,17,21H,8-10,12H2,1-5H3/t13-,17-,19+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.02E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059770 ((2R,6R)-3-((R)-2-Methoxy-propyl)-6,11,11-trimethyl...) Show SMILES CO[C@H](C)CN1CC[C@@]2(C)c3c(O)cccc3C[C@@H]1C2(C)C |TLB:4:5:19:10.16.17| Show InChI InChI=1S/C19H29NO2/c1-13(22-5)12-20-10-9-19(4)17-14(7-6-8-15(17)21)11-16(20)18(19,2)3/h6-8,13,16,21H,9-12H2,1-5H3/t13-,16-,19+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.14E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059776 ((2S,6R)-3-((R)-2-Methoxy-propyl)-6,11,11-trimethyl...) Show SMILES CO[C@H](C)CN1CC[C@]2(C)c3cc(O)ccc3C[C@H]1C2(C)C |TLB:4:5:19:10.16.17| Show InChI InChI=1S/C19H29NO2/c1-13(22-5)12-20-9-8-19(4)16-11-15(21)7-6-14(16)10-17(20)18(19,2)3/h6-7,11,13,17,21H,8-10,12H2,1-5H3/t13-,17+,19-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059774 ((2S,6R,11S)-3-((R)-2-Methoxy-propyl)-6,11-dimethyl...) Show SMILES CO[C@H](C)CN1CC[C@]2(C)[C@H](C)[C@@H]1Cc1ccc(O)cc21 |THB:4:5:10:20.14.13| Show InChI InChI=1S/C18H27NO2/c1-12(21-4)11-19-8-7-18(3)13(2)17(19)9-14-5-6-15(20)10-16(14)18/h5-6,10,12-13,17,20H,7-9,11H2,1-4H3/t12-,13-,17+,18-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.84E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059773 ((2S,6R,11R)-3-((R)-2-Methoxy-propyl)-6,11-dimethyl...) Show SMILES CO[C@H](C)CN1CC[C@]2(C)[C@@H](C)[C@@H]1Cc1ccc(O)cc21 |THB:4:5:10:20.14.13| Show InChI InChI=1S/C18H27NO2/c1-12(21-4)11-19-8-7-18(3)13(2)17(19)9-14-5-6-15(20)10-16(14)18/h5-6,10,12-13,17,20H,7-9,11H2,1-4H3/t12-,13+,17+,18-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.48E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059763 ((2R,6S)-3-((R)-2-Methoxy-propyl)-6,11,11-trimethyl...) Show SMILES CO[C@H](C)CN1CC[C@@]2(C)c3ccccc3C[C@@H]1C2(C)C |TLB:4:5:18:10.16.15| Show InChI InChI=1S/C19H29NO/c1-14(21-5)13-20-11-10-19(4)16-9-7-6-8-15(16)12-17(20)18(19,2)3/h6-9,14,17H,10-13H2,1-5H3/t14-,17-,19+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.24E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50059768 ((2S,6R,11R)-3-((S)-2-Methoxy-propyl)-6,11-dimethyl...) Show SMILES CO[C@@H](C)CN1CC[C@]2(C)[C@@H](C)[C@@H]1Cc1ccc(O)cc21 |THB:4:5:10:20.14.13| Show InChI InChI=1S/C18H27NO2/c1-12(21-4)11-19-8-7-18(3)13(2)17(19)9-14-5-6-15(20)10-16(14)18/h5-6,10,12-13,17,20H,7-9,11H2,1-4H3/t12-,13-,17-,18+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.66E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]-dihydromorphine binding to opioid receptor mu 1 in rat brain cortical membranes.				J Med Chem 40: 2922-30 (1997) Article DOI: 10.1021/jm970131j BindingDB Entry DOI: 10.7270/Q2W66JW9
					More data for this Ligand-Target Pair
Glycogen synthase kinase-3 beta (Homo sapiens (Human))	BDBM50239773 (CHEMBL492244) Show SMILES Cl.CN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C23H24BrN5O2/c1-28-8-10-29(11-9-28)12-13-31-27-21-17-4-2-3-5-18(17)25-22(21)20-16-7-6-15(24)14-19(16)26-23(20)30/h2-7,14,25H,8-13H2,1H3,(H,26,30)/b22-20-,27-21+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST/His6-tagged GSK3beta (M1 to T420 residues) expressed in baculovirus infected sf9 cells using RBER-IRStide as subst...				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D (Homo sapiens (Human))	BDBM50471928 (CHEMBL141487) Show SMILES Clc1nc2c(nc(nc2nc1NCc1ccccc1)N1CCNCC1)N1CCCC1 Show InChI InChI=1S/C21H25ClN8/c22-17-19(24-14-15-6-2-1-3-7-15)26-18-16(25-17)20(29-10-4-5-11-29)28-21(27-18)30-12-8-23-9-13-30/h1-3,6-7,23H,4-5,8-14H2,(H,24,26,27,28)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of cAMP hydrolysis by inhibiting phosphodiesterases (PDE4), isolated from tumor tissue of human large cell lung tumor xenograft LXFL-529, ...				J Med Chem 41: 4733-43 (1998) Article DOI: 10.1021/jm981021v BindingDB Entry DOI: 10.7270/Q2SN0CQ8
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1 (Homo sapiens (Human))	BDBM50239780 (CHEMBL4065365) Show SMILES COc1ccc2NC(=O)\C(=C3/Nc4ccccc4/C/3=N\OCC(O)CO)c2c1 Show InChI InChI=1S/C20H19N3O5/c1-27-12-6-7-16-14(8-12)17(20(26)22-16)19-18(23-28-10-11(25)9-24)13-4-2-3-5-15(13)21-19/h2-8,11,21,24-25H,9-10H2,1H3,(H,22,26)/b19-17-,23-18+	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	43	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of full length human C-terminal His6-tagged CDK2/N-terminal GST-tagged CyclinE expressed in baculovirus infected sf21 cells after 10 mins ...				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D (Homo sapiens (Human))	BDBM50471936 (CHEMBL141890) Show SMILES CN(C)c1nc2nc(nc(N3CCCC3)c2nc1Cl)N1CCNCC1 Show InChI InChI=1S/C16H23ClN8/c1-23(2)15-12(17)19-11-13(20-15)21-16(25-9-5-18-6-10-25)22-14(11)24-7-3-4-8-24/h18H,3-10H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of cAMP hydrolysis by inhibiting phosphodiesterases (PDE4), isolated from tumor tissue of human large cell lung tumor xenograft LXFL-529, ...				J Med Chem 41: 4733-43 (1998) Article DOI: 10.1021/jm981021v BindingDB Entry DOI: 10.7270/Q2SN0CQ8
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1 (Homo sapiens (Human))	BDBM50239778 (CHEMBL1830064) Show SMILES COc1ccc2NC(=O)\C(=C3/Nc4ccccc4/C/3=N\O)c2c1 Show InChI InChI=1S/C17H13N3O3/c1-23-9-6-7-13-11(8-9)14(17(21)19-13)16-15(20-22)10-4-2-3-5-12(10)18-16/h2-8,18,22H,1H3,(H,19,21)/b16-14-,20-15+	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	54	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of compound against thymidylate synthetase				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D (Homo sapiens (Human))	BDBM50471931 (CHEMBL341615) Show SMILES Clc1nc2c(nc(nc2nc1N1CCCC1)N1CCNCC1)N1CCCC1 Show InChI InChI=1S/C18H25ClN8/c19-14-17(26-9-3-4-10-26)22-15-13(21-14)16(25-7-1-2-8-25)24-18(23-15)27-11-5-20-6-12-27/h20H,1-12H2	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	59	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of cAMP hydrolysis by inhibiting phosphodiesterases (PDE4), isolated from tumor tissue of human large cell lung tumor xenograft LXFL-529, ...				J Med Chem 41: 4733-43 (1998) Article DOI: 10.1021/jm981021v BindingDB Entry DOI: 10.7270/Q2SN0CQ8
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 6/G1/S-specific cyclin-D3 (Homo sapiens (Human))	BDBM50005337 (CHEMBL1276317) Show SMILES OCC(O)CO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2ccccc12 Show InChI InChI=1S/C19H17N3O4/c23-9-11(24)10-26-22-17-13-6-2-4-8-15(13)20-18(17)16-12-5-1-3-7-14(12)21-19(16)25/h1-8,11,20,23-24H,9-10H2,(H,21,25)/b18-16-,22-17+	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of compound against Guanine-7-methyl transferase				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D (Homo sapiens (Human))	BDBM50471939 (CHEMBL343232) Show SMILES Clc1nc2c(NCc3ccccc3)nc(nc2nc1N1CCCC1)N1CCNCC1 Show InChI InChI=1S/C21H25ClN8/c22-17-20(29-10-4-5-11-29)26-19-16(25-17)18(24-14-15-6-2-1-3-7-15)27-21(28-19)30-12-8-23-9-13-30/h1-3,6-7,23H,4-5,8-14H2,(H,24,26,27,28)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	83	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of cAMP hydrolysis by inhibiting phosphodiesterases (PDE4), isolated from tumor tissue of human large cell lung tumor xenograft LXFL-529, ...				J Med Chem 41: 4733-43 (1998) Article DOI: 10.1021/jm981021v BindingDB Entry DOI: 10.7270/Q2SN0CQ8
					More data for this Ligand-Target Pair
Glycogen synthase kinase-3 beta (Homo sapiens (Human))	BDBM50239778 (CHEMBL1830064) Show SMILES COc1ccc2NC(=O)\C(=C3/Nc4ccccc4/C/3=N\O)c2c1 Show InChI InChI=1S/C17H13N3O3/c1-23-9-6-7-13-11(8-9)14(17(21)19-13)16-15(20-22)10-4-2-3-5-12(10)18-16/h2-8,18,22H,1H3,(H,19,21)/b16-14-,20-15+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of recombinant GSK3beta (unknown origin) after 10 mins in presence of [gamma32P]ATP by beta counting method				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1 (Homo sapiens (Human))	BDBM50239776 (CHEMBL4085289) Show SMILES COc1ccc2NC(=O)\C(=C3\Nc4ccccc4\C\3=N/OCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2c1 |r| Show InChI InChI=1S/C25H27N3O9/c1-34-12-6-7-16-14(10-12)18(24(33)27-16)20-19(13-4-2-3-5-15(13)26-20)28-36-9-8-35-25-23(32)22(31)21(30)17(11-29)37-25/h2-7,10,17,21-23,25-26,29-32H,8-9,11H2,1H3,(H,27,33)/b20-18+,28-19+/t17-,21-,22+,23-,25-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Displacement of [125 I] CCK-8 from Cholecystokinin type B receptor of guinea pig cerebral cortex				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
Glycogen synthase kinase-3 beta (Homo sapiens (Human))	BDBM50239776 (CHEMBL4085289) Show SMILES COc1ccc2NC(=O)\C(=C3\Nc4ccccc4\C\3=N/OCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2c1 |r| Show InChI InChI=1S/C25H27N3O9/c1-34-12-6-7-16-14(10-12)18(24(33)27-16)20-19(13-4-2-3-5-15(13)26-20)28-36-9-8-35-25-23(32)22(31)21(30)17(11-29)37-25/h2-7,10,17,21-23,25-26,29-32H,8-9,11H2,1H3,(H,27,33)/b20-18+,28-19+/t17-,21-,22+,23-,25-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of recombinant GSK3beta (unknown origin) after 10 mins in presence of [gamma32P]ATP by beta counting method				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
Glycogen synthase kinase-3 beta (Homo sapiens (Human))	BDBM50321062 (5-{N-[4-(4-Methylpiperazino)-phenyl]-aminocarbonyl...) Show SMILES CN1CCN(CC1)c1ccc(NC(=O)c2ccc3NC(=O)C(=C4Nc5ccccc5C4=O)c3c2)cc1 |w:22.23| Show InChI InChI=1S/C28H25N5O3/c1-32-12-14-33(15-13-32)19-9-7-18(8-10-19)29-27(35)17-6-11-23-21(16-17)24(28(36)31-23)25-26(34)20-4-2-3-5-22(20)30-25/h2-11,16,30H,12-15H2,1H3,(H,29,35)(H,31,36)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of GSK3beta assessed as inhibition of [33Pi] incorporation after 80 mins by microplate scintillation counting				Bioorg Med Chem 18: 4509-15 (2010) Article DOI: 10.1016/j.bmc.2010.04.066 BindingDB Entry DOI: 10.7270/Q2445MN3
					More data for this Ligand-Target Pair
Glycogen synthase kinase-3 beta (Homo sapiens (Human))	BDBM50005337 (CHEMBL1276317) Show SMILES OCC(O)CO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2ccccc12 Show InChI InChI=1S/C19H17N3O4/c23-9-11(24)10-26-22-17-13-6-2-4-8-15(13)20-18(17)16-12-5-1-3-7-14(12)21-19(16)25/h1-8,11,20,23-24H,9-10H2,(H,21,25)/b18-16-,22-17+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of recombinant GSK3beta (unknown origin) after 10 mins in presence of [gamma32P]ATP by beta counting method				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 6/G1/S-specific cyclin-D3 (Homo sapiens (Human))	BDBM50239778 (CHEMBL1830064) Show SMILES COc1ccc2NC(=O)\C(=C3/Nc4ccccc4/C/3=N\O)c2c1 Show InChI InChI=1S/C17H13N3O3/c1-23-9-6-7-13-11(8-9)14(17(21)19-13)16-15(20-22)10-4-2-3-5-12(10)18-16/h2-8,18,22H,1H3,(H,19,21)/b16-14-,20-15+	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal His6-tagged CDK6/N-terminal GST-tagged CyclinD3 expressed in sf21 cells after 10 mins in presence of [gamm...				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM50239774 (CHEMBL4084775) Show SMILES Cl.CN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3ccccc23)CC1 Show InChI InChI=1S/C23H25N5O2/c1-27-10-12-28(13-11-27)14-15-30-26-21-17-7-3-5-9-19(17)24-22(21)20-16-6-2-4-8-18(16)25-23(20)29/h2-9,24H,10-15H2,1H3,(H,25,29)/b22-20-,26-21+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	169	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of IGF1R (unknown origin) by ADP-Glo assay				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1 (Homo sapiens (Human))	BDBM50005337 (CHEMBL1276317) Show SMILES OCC(O)CO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2ccccc12 Show InChI InChI=1S/C19H17N3O4/c23-9-11(24)10-26-22-17-13-6-2-4-8-15(13)20-18(17)16-12-5-1-3-7-14(12)21-19(16)25/h1-8,11,20,23-24H,9-10H2,(H,21,25)/b18-16-,22-17+	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of full length human C-terminal His6-tagged CDK2/N-terminal GST-tagged CyclinE expressed in baculovirus infected sf21 cells after 10 mins ...				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
Cyclin-A2/Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50239778 (CHEMBL1830064) Show SMILES COc1ccc2NC(=O)\C(=C3/Nc4ccccc4/C/3=N\O)c2c1 Show InChI InChI=1S/C17H13N3O3/c1-23-9-6-7-13-11(8-9)14(17(21)19-13)16-15(20-22)10-4-2-3-5-12(10)18-16/h2-8,18,22H,1H3,(H,19,21)/b16-14-,20-15+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of full length human C-terminal His6-tagged CDK2/N-terminal GST-tagged CyclinA expressed in baculovirus infected sf21 cells after 10 mins ...				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1 (Homo sapiens (Human))	BDBM50239779 (CHEMBL1802727) Show SMILES OCC(O)CCO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2ccccc12 Show InChI InChI=1S/C20H19N3O4/c24-11-12(25)9-10-27-23-18-14-6-2-4-8-16(14)21-19(18)17-13-5-1-3-7-15(13)22-20(17)26/h1-8,12,21,24-25H,9-11H2,(H,22,26)/b19-17-,23-18+	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of full length human C-terminal His6-tagged CDK2/N-terminal GST-tagged CyclinE expressed in baculovirus infected sf21 cells after 10 mins ...				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
Glycogen synthase kinase-3 beta (Homo sapiens (Human))	BDBM50239777 (CHEMBL4100748) Show SMILES Cc1ccc2NC(=O)\C(=C3/Nc4ccccc4/C/3=N\OCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2c1 |r| Show InChI InChI=1S/C25H27N3O8/c1-12-6-7-16-14(10-12)18(24(33)27-16)20-19(13-4-2-3-5-15(13)26-20)28-35-9-8-34-25-23(32)22(31)21(30)17(11-29)36-25/h2-7,10,17,21-23,25-26,29-32H,8-9,11H2,1H3,(H,27,33)/b20-18-,28-19+/t17-,21-,22+,23-,25-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of recombinant GSK3beta (unknown origin) after 10 mins in presence of [gamma32P]ATP by beta counting method				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D (Homo sapiens (Human))	BDBM50471930 (CHEMBL142504) Show SMILES CN(C)c1nc(nc2nc(NCc3ccccc3)c(Cl)nc12)N1CCNCC1 Show InChI InChI=1S/C19H23ClN8/c1-27(2)18-14-16(25-19(26-18)28-10-8-21-9-11-28)24-17(15(20)23-14)22-12-13-6-4-3-5-7-13/h3-7,21H,8-12H2,1-2H3,(H,22,24,25,26)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of cAMP hydrolysis by inhibiting phosphodiesterases (PDE4), isolated from tumor tissue of human large cell lung tumor xenograft LXFL-529, ...				J Med Chem 41: 4733-43 (1998) Article DOI: 10.1021/jm981021v BindingDB Entry DOI: 10.7270/Q2SN0CQ8
					More data for this Ligand-Target Pair
Cyclin-dependent kinase/G2/mitotic-specific cyclin- 1 (Homo sapiens (Human))	BDBM50239773 (CHEMBL492244) Show SMILES Cl.CN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C23H24BrN5O2/c1-28-8-10-29(11-9-28)12-13-31-27-21-17-4-2-3-5-18(17)25-22(21)20-16-7-6-15(24)14-19(16)26-23(20)30/h2-7,14,25H,8-13H2,1H3,(H,26,30)/b22-20-,27-21+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Displacement of [125 I] CCK-8 from Cholecystokinin type B receptor of guinea pig cerebral cortex				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D (Homo sapiens (Human))	BDBM50471935 (CHEMBL141380) Show SMILES C(Nc1cnc2c(nc(nc2n1)N1CCNCC1)N1CCCC1)c1ccccc1 Show InChI InChI=1S/C21H26N8/c1-2-6-16(7-3-1)14-23-17-15-24-18-19(25-17)26-21(29-12-8-22-9-13-29)27-20(18)28-10-4-5-11-28/h1-3,6-7,15,22H,4-5,8-14H2,(H,23,25,26,27)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of cAMP hydrolysis by inhibiting phosphodiesterases (PDE4), isolated from tumor tissue of human large cell lung tumor xenograft LXFL-529, ...				J Med Chem 41: 4733-43 (1998) Article DOI: 10.1021/jm981021v BindingDB Entry DOI: 10.7270/Q2SN0CQ8
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 6/G1/S-specific cyclin-D3 (Homo sapiens (Human))	BDBM50239776 (CHEMBL4085289) Show SMILES COc1ccc2NC(=O)\C(=C3\Nc4ccccc4\C\3=N/OCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2c1 |r| Show InChI InChI=1S/C25H27N3O9/c1-34-12-6-7-16-14(10-12)18(24(33)27-16)20-19(13-4-2-3-5-15(13)26-20)28-36-9-8-35-25-23(32)22(31)21(30)17(11-29)37-25/h2-7,10,17,21-23,25-26,29-32H,8-9,11H2,1H3,(H,27,33)/b20-18+,28-19+/t17-,21-,22+,23-,25-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	410	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal His6-tagged CDK6/N-terminal GST-tagged CyclinD3 expressed in sf21 cells after 10 mins in presence of [gamm...				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1 (Homo sapiens (Human))	BDBM50239773 (CHEMBL492244) Show SMILES Cl.CN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C23H24BrN5O2/c1-28-8-10-29(11-9-28)12-13-31-27-21-17-4-2-3-5-18(17)25-22(21)20-16-7-6-15(24)14-19(16)26-23(20)30/h2-7,14,25H,8-13H2,1H3,(H,26,30)/b22-20-,27-21+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST-tagged CDK5 (M1 to P292 residues)/p35NCK (M1 to R307 residues) expressed in baculovirus infected sf9 c...				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
Cyclin-A2/Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50005337 (CHEMBL1276317) Show SMILES OCC(O)CO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2ccccc12 Show InChI InChI=1S/C19H17N3O4/c23-9-11(24)10-26-22-17-13-6-2-4-8-15(13)20-18(17)16-12-5-1-3-7-14(12)21-19(16)25/h1-8,11,20,23-24H,9-10H2,(H,21,25)/b18-16-,22-17+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of full length human C-terminal His6-tagged CDK2/N-terminal GST-tagged CyclinA expressed in baculovirus infected sf21 cells after 10 mins ...				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair
Glycogen synthase kinase-3 beta (Homo sapiens (Human))	BDBM7392 (2-[(3Z)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2,3-...) Show SMILES O=C1Nc2ccccc2\C1=C1\Nc2ccccc2C1=O Show InChI InChI=1S/C16H10N2O2/c19-15-10-6-2-4-8-12(10)17-14(15)13-9-5-1-3-7-11(9)18-16(13)20/h1-8,17H,(H,18,20)/b14-13-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
University of Kaiserslautern Curated by ChEMBL					Assay Description Inhibition of recombinant GSK3beta (unknown origin) after 10 mins in presence of [gamma32P]ATP by beta counting method				J Med Chem 60: 4949-4962 (2017) Article DOI: 10.1021/acs.jmedchem.7b00324 BindingDB Entry DOI: 10.7270/Q2HM5BMK
					More data for this Ligand-Target Pair

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