Compile Data Set for Download or QSAR

Found 37 hits with Last Name = 'tomioka' and Initial = 'n'   

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
Protein kinase C delta type (Homo sapiens (Human))	BDBM50064089 (4-hydroxymethyl-7,10-diisopropyl-8,10,13-trimethyl...) Show SMILES CC(C)[C@@H]1N(C)c2cc3c(c4[nH]cc(C[C@@H](CO)NC1=O)c24)[C@](C)(CC[C@]3(C)C(C)C)C=C |r| Show InChI InChI=1S/C28H41N3O2/c1-9-27(6)10-11-28(7,17(4)5)20-13-21-22-18(14-29-24(22)23(20)27)12-19(15-32)30-26(33)25(16(2)3)31(21)8/h9,13-14,16-17,19,25,29,32H,1,10-12,15H2,2-8H3,(H,30,33)/t19-,25-,27-,28+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	0.320	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from recombinant Protein kinase C delta				J Med Chem 41: 1476-96 (1998) Article DOI: 10.1021/jm970704s BindingDB Entry DOI: 10.7270/Q2RV0MT8
					More data for this Ligand-Target Pair
Protein kinase C delta type (Homo sapiens (Human))	BDBM50064090 ((S)-2-Decyl-5-hydroxymethyl-1-methyl-1,4,5,6-tetra...) Show SMILES CCCCCCCCCCC1N(C)c2ccccc2C[C@@H](CO)NC1=O Show InChI InChI=1S/C22H36N2O2/c1-3-4-5-6-7-8-9-10-15-21-22(26)23-19(17-25)16-18-13-11-12-14-20(18)24(21)2/h11-14,19,21,25H,3-10,15-17H2,1-2H3,(H,23,26)/t19-,21?/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from recombinant Protein kinase C delta				J Med Chem 41: 1476-96 (1998) Article DOI: 10.1021/jm970704s BindingDB Entry DOI: 10.7270/Q2RV0MT8
					More data for this Ligand-Target Pair
Protein kinase C delta type (Homo sapiens (Human))	BDBM50064091 ((2S,5S)-9-Decyl-5-hydroxymethyl-2-isopropyl-1-meth...) Show SMILES CCCCCCCCCCc1ccc2C[C@@H](CO)NC(=O)[C@H](C(C)C)N(C)c2c1 Show InChI InChI=1S/C25H42N2O2/c1-5-6-7-8-9-10-11-12-13-20-14-15-21-17-22(18-28)26-25(29)24(19(2)3)27(4)23(21)16-20/h14-16,19,22,24,28H,5-13,17-18H2,1-4H3,(H,26,29)/t22-,24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	5.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from recombinant Protein kinase C delta				J Med Chem 41: 1476-96 (1998) Article DOI: 10.1021/jm970704s BindingDB Entry DOI: 10.7270/Q2RV0MT8
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50073876 ((1S,4S,5aS,9aS)-7,7-Dibutyl-4-hydroxymethyl-5a-met...) Show SMILES CCCCCCCC[C@H]1[C@@H]2CCC(CCCC)(CCCC)C[C@@]2(C)C[C@@H](CO)NC1=O Show InChI InChI=1S/C28H53NO2/c1-5-8-11-12-13-14-15-24-25-16-19-28(17-9-6-2,18-10-7-3)22-27(25,4)20-23(21-30)29-26(24)31/h23-25,30H,5-22H2,1-4H3,(H,29,31)/t23-,24-,25-,27+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from human recombinant Protein kinase C alpha				Bioorg Med Chem Lett 9: 173-8 (1999) BindingDB Entry DOI: 10.7270/Q2WQ02Z9
					More data for this Ligand-Target Pair
Protein kinase C delta type (Homo sapiens (Human))	BDBM50064092 (5'-hydroxymethyl-2'-isopropyl-1',4,4-trimethyl-(2'...) Show SMILES CC(C)[C@@H]1N(C)c2cc3c(CCCC33CCC(C)(C)CC3)cc2C[C@@H](CO)NC1=O Show InChI InChI=1S/C26H40N2O2/c1-17(2)23-24(30)27-20(16-29)14-19-13-18-7-6-8-26(11-9-25(3,4)10-12-26)21(18)15-22(19)28(23)5/h13,15,17,20,23,29H,6-12,14,16H2,1-5H3,(H,27,30)/t20-,23-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from recombinant Protein kinase C delta				J Med Chem 41: 1476-96 (1998) Article DOI: 10.1021/jm970704s BindingDB Entry DOI: 10.7270/Q2RV0MT8
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50073875 ((1S,4S,5aS,9aS)-1,7,7-Tributyl-4-hydroxymethyl-5a-...) Show SMILES CCCC[C@H]1[C@@H]2CCC(CCCC)(CCCC)C[C@@]2(C)C[C@@H](CO)NC1=O Show InChI InChI=1S/C24H45NO2/c1-5-8-11-20-21-12-15-24(13-9-6-2,14-10-7-3)18-23(21,4)16-19(17-26)25-22(20)27/h19-21,26H,5-18H2,1-4H3,(H,25,27)/t19-,20-,21-,23+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from human recombinant Protein kinase C alpha				Bioorg Med Chem Lett 9: 173-8 (1999) BindingDB Entry DOI: 10.7270/Q2WQ02Z9
					More data for this Ligand-Target Pair
Protein kinase C delta type (Homo sapiens (Human))	BDBM50064094 (5'-hydroxymethyl-2'-isopropyl-1'-methyl-(2'S,5'S)-...) Show SMILES CC(C)[C@@H]1N(C)c2cc3c(CCCC33CCCCC3)cc2C[C@@H](CO)NC1=O Show InChI InChI=1S/C24H36N2O2/c1-16(2)22-23(28)25-19(15-27)13-18-12-17-8-7-11-24(9-5-4-6-10-24)20(17)14-21(18)26(22)3/h12,14,16,19,22,27H,4-11,13,15H2,1-3H3,(H,25,28)/t19-,22-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from recombinant Protein kinase C delta				J Med Chem 41: 1476-96 (1998) Article DOI: 10.1021/jm970704s BindingDB Entry DOI: 10.7270/Q2RV0MT8
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50073873 ((1S,4S,5aS,9aS)-7,7-Dibutyl-4-hydroxymethyl-1,5a-d...) Show SMILES CCCCC1(CCCC)CC[C@H]2[C@H](C)C(=O)N[C@H](CO)C[C@]2(C)C1 Show InChI InChI=1S/C21H39NO2/c1-5-7-10-21(11-8-6-2)12-9-18-16(3)19(24)22-17(14-23)13-20(18,4)15-21/h16-18,23H,5-15H2,1-4H3,(H,22,24)/t16-,17-,18-,20+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from human recombinant Protein kinase C alpha				Bioorg Med Chem Lett 9: 173-8 (1999) BindingDB Entry DOI: 10.7270/Q2WQ02Z9
					More data for this Ligand-Target Pair
Protein kinase C delta type (Homo sapiens (Human))	BDBM50057510 ((2S,5S)-8-Decyl-5-hydroxymethyl-2-isopropyl-1-meth...) Show SMILES CCCCCCCCCCc1ccc2N(C)[C@@H](C(C)C)C(=O)N[C@H](CO)Cc2c1 Show InChI InChI=1S/C25H42N2O2/c1-5-6-7-8-9-10-11-12-13-20-14-15-23-21(16-20)17-22(18-28)26-25(29)24(19(2)3)27(23)4/h14-16,19,22,24,28H,5-13,17-18H2,1-4H3,(H,26,29)/t22-,24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from recombinant Protein kinase C delta				J Med Chem 41: 1476-96 (1998) Article DOI: 10.1021/jm970704s BindingDB Entry DOI: 10.7270/Q2RV0MT8
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50073874 ((4S,5aS,9aS)-7,7-Dibutyl-4-hydroxymethyl-5a-methyl...) Show SMILES CCCCC1(CCCC)CC[C@H]2CC(=O)N[C@H](CO)C[C@]2(C)C1 Show InChI InChI=1S/C20H37NO2/c1-4-6-9-20(10-7-5-2)11-8-16-12-18(23)21-17(14-22)13-19(16,3)15-20/h16-17,22H,4-15H2,1-3H3,(H,21,23)/t16-,17-,19+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from human recombinant Protein kinase C alpha				Bioorg Med Chem Lett 9: 173-8 (1999) BindingDB Entry DOI: 10.7270/Q2WQ02Z9
					More data for this Ligand-Target Pair
Protein kinase C delta type (Homo sapiens (Human))	BDBM50064093 ((7S,10S)-10-Hydroxymethyl-7-isopropyl-4,4,6-trimet...) Show SMILES CC(C)[C@@H]1N(C)c2cc3c(CCCC3(C)C)cc2C[C@@H](CO)NC1=O Show InChI InChI=1S/C21H32N2O2/c1-13(2)19-20(25)22-16(12-24)10-15-9-14-7-6-8-21(3,4)17(14)11-18(15)23(19)5/h9,11,13,16,19,24H,6-8,10,12H2,1-5H3,(H,22,25)/t16-,19-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	65	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from recombinant Protein kinase C delta				J Med Chem 41: 1476-96 (1998) Article DOI: 10.1021/jm970704s BindingDB Entry DOI: 10.7270/Q2RV0MT8
					More data for this Ligand-Target Pair
Protein kinase C delta type (Homo sapiens (Human))	BDBM50057511 ((+/-)-indolactum-V 13-Hydroxymethyl-10-isopropyl-9...) Show SMILES CC(C)[C@@H]1N(C)c2cccc3[nH]cc(C[C@@H](CO)NC1=O)c23 Show InChI InChI=1S/C17H23N3O2/c1-10(2)16-17(22)19-12(9-21)7-11-8-18-13-5-4-6-14(15(11)13)20(16)3/h4-6,8,10,12,16,18,21H,7,9H2,1-3H3,(H,19,22)/t12-,16-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from recombinant Protein kinase C delta				J Med Chem 41: 1476-96 (1998) Article DOI: 10.1021/jm970704s BindingDB Entry DOI: 10.7270/Q2RV0MT8
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50073874 ((4S,5aS,9aS)-7,7-Dibutyl-4-hydroxymethyl-5a-methyl...) Show SMILES CCCCC1(CCCC)CC[C@H]2CC(=O)N[C@H](CO)C[C@]2(C)C1 Show InChI InChI=1S/C20H37NO2/c1-4-6-9-20(10-7-5-2)11-8-16-12-18(23)21-17(14-22)13-19(16,3)15-20/h16-17,22H,4-15H2,1-3H3,(H,21,23)/t16-,17-,19+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from human recombinant Protein kinase C alpha				Bioorg Med Chem Lett 9: 173-8 (1999) BindingDB Entry DOI: 10.7270/Q2WQ02Z9
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50073878 ((4R,5aS,9aS)-7,7-Dibutyl-4-hydroxymethyl-5a-methyl...) Show SMILES CCCCC1(CCCC)CC[C@H]2CC(=O)N[C@@H](CO)C[C@]2(C)C1 Show InChI InChI=1S/C20H37NO2/c1-4-6-9-20(10-7-5-2)11-8-16-12-18(23)21-17(14-22)13-19(16,3)15-20/h16-17,22H,4-15H2,1-3H3,(H,21,23)/t16-,17+,19+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	190	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from human recombinant Protein kinase C alpha				Bioorg Med Chem Lett 9: 173-8 (1999) BindingDB Entry DOI: 10.7270/Q2WQ02Z9
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50073872 ((4S,5aS,5bS,7aS,10aS,10bS,12aS)-4-Hydroxymethyl-5a...) Show SMILES C[C@@]12CCC[C@H]1[C@@H]1CC[C@H]3CC(=O)N[C@H](CO)C[C@]3(C)[C@H]1CC2 Show InChI InChI=1S/C20H33NO2/c1-19-8-3-4-16(19)15-6-5-13-10-18(23)21-14(12-22)11-20(13,2)17(15)7-9-19/h13-17,22H,3-12H2,1-2H3,(H,21,23)/t13-,14-,15-,16-,17-,19-,20-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from human recombinant Protein kinase C alpha				Bioorg Med Chem Lett 9: 173-8 (1999) BindingDB Entry DOI: 10.7270/Q2WQ02Z9
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50073870 ((4R,5aS,5bS,7aR,8R,10aS,10bR,12aS)-8-(1,5-Dimethyl...) Show SMILES CC(C)CCCC(C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)N[C@@H](CO)C[C@]4(C)[C@H]3CC[C@]12C Show InChI InChI=1S/C28H49NO2/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-15-26(31)29-21(17-30)16-28(20,5)25(22)13-14-27(23,24)4/h18-25,30H,6-17H2,1-5H3,(H,29,31)/t19?,20-,21+,22-,23+,24-,25-,27+,28-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from human recombinant Protein kinase C alpha				Bioorg Med Chem Lett 9: 173-8 (1999) BindingDB Entry DOI: 10.7270/Q2WQ02Z9
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50073871 ((4R,5aS,5bS,7aS,10aS,10bS,12aS)-4-Hydroxymethyl-5a...) Show SMILES C[C@@]12CCC[C@H]1[C@@H]1CC[C@H]3CC(=O)N[C@@H](CO)C[C@]3(C)[C@H]1CC2 Show InChI InChI=1S/C20H33NO2/c1-19-8-3-4-16(19)15-6-5-13-10-18(23)21-14(12-22)11-20(13,2)17(15)7-9-19/h13-17,22H,3-12H2,1-2H3,(H,21,23)/t13-,14+,15-,16-,17-,19-,20-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from human recombinant Protein kinase C alpha				Bioorg Med Chem Lett 9: 173-8 (1999) BindingDB Entry DOI: 10.7270/Q2WQ02Z9
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50073877 ((4S,5aS,5bS,7aR,8R,10aS,10bR,12aS)-8-(1,5-Dimethyl...) Show SMILES CC(C)CCCC(C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)N[C@H](CO)C[C@]4(C)[C@H]3CC[C@]12C Show InChI InChI=1S/C28H49NO2/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-15-26(31)29-21(17-30)16-28(20,5)25(22)13-14-27(23,24)4/h18-25,30H,6-17H2,1-5H3,(H,29,31)/t19?,20-,21-,22-,23+,24-,25-,27+,28-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from human recombinant Protein kinase C alpha				Bioorg Med Chem Lett 9: 173-8 (1999) BindingDB Entry DOI: 10.7270/Q2WQ02Z9
					More data for this Ligand-Target Pair
Protein kinase C delta type (Homo sapiens (Human))	BDBM50057513 ((2S,5S)-5-Hydroxymethyl-2-isopropyl-1-methyl-1,4,5...) Show SMILES CC(C)[C@@H]1N(C)c2ccccc2C[C@@H](CO)NC1=O Show InChI InChI=1S/C15H22N2O2/c1-10(2)14-15(19)16-12(9-18)8-11-6-4-5-7-13(11)17(14)3/h4-7,10,12,14,18H,8-9H2,1-3H3,(H,16,19)/t12-,14-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from recombinant Protein kinase C delta				J Med Chem 41: 1476-96 (1998) Article DOI: 10.1021/jm970704s BindingDB Entry DOI: 10.7270/Q2RV0MT8
					More data for this Ligand-Target Pair
Protein kinase C delta type (Homo sapiens (Human))	BDBM50064088 ((7S,10S)-10-Hydroxymethyl-7-isopropyl-1,1,6-trimet...) Show SMILES CC(C)[C@@H]1N(C)c2cc3CCCC(C)(C)c3cc2C[C@@H](CO)NC1=O Show InChI InChI=1S/C21H32N2O2/c1-13(2)19-20(25)22-16(12-24)9-15-10-17-14(11-18(15)23(19)5)7-6-8-21(17,3)4/h10-11,13,16,19,24H,6-9,12H2,1-5H3,(H,22,25)/t16-,19-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from recombinant Protein kinase C delta				J Med Chem 41: 1476-96 (1998) Article DOI: 10.1021/jm970704s BindingDB Entry DOI: 10.7270/Q2RV0MT8
					More data for this Ligand-Target Pair
Protein kinase C delta type (Homo sapiens (Human))	BDBM50064095 ((7S,10S)-10-Hydroxymethyl-7-isopropyl-1,1,4,4,6-pe...) Show SMILES CC(C)[C@@H]1N(C)c2cc3c(cc2C[C@@H](CO)NC1=O)C(C)(C)CCC3(C)C Show InChI InChI=1S/C23H36N2O2/c1-14(2)20-21(27)24-16(13-26)10-15-11-17-18(12-19(15)25(20)7)23(5,6)9-8-22(17,3)4/h11-12,14,16,20,26H,8-10,13H2,1-7H3,(H,24,27)/t16-,20-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.10E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from recombinant Protein kinase C delta				J Med Chem 41: 1476-96 (1998) Article DOI: 10.1021/jm970704s BindingDB Entry DOI: 10.7270/Q2RV0MT8
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM50099669 (CHEMBL295139 | Succinic acid benzyl ester 3-carbox...) Show SMILES Cc1c(CC(O)=O)c2cc(OC(=O)CCC(=O)OCc3ccccc3)ccc2n1C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C29H24ClNO7/c1-18-23(16-26(32)33)24-15-22(11-12-25(24)31(18)29(36)20-7-9-21(30)10-8-20)38-28(35)14-13-27(34)37-17-19-5-3-2-4-6-19/h2-12,15H,13-14,16-17H2,1H3,(H,32,33)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM50099672 (CHEMBL50599 | Succinic acid 3-carboxymethyl-1-(4-c...) Show SMILES CC(OC(=O)CCC(=O)Oc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1)c1ccccc1 Show InChI InChI=1S/C30H26ClNO7/c1-18-24(17-27(33)34)25-16-23(12-13-26(25)32(18)30(37)21-8-10-22(31)11-9-21)39-29(36)15-14-28(35)38-19(2)20-6-4-3-5-7-20/h3-13,16,19H,14-15,17H2,1-2H3,(H,33,34)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM50099675 (CHEMBL416825 | Succinic acid 3-carboxymethyl-1-(4-...) Show SMILES CCC(CC)OC(=O)CCC(=O)Oc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1 Show InChI InChI=1S/C27H28ClNO7/c1-4-19(5-2)35-25(32)12-13-26(33)36-20-10-11-23-22(14-20)21(15-24(30)31)16(3)29(23)27(34)17-6-8-18(28)9-7-17/h6-11,14,19H,4-5,12-13,15H2,1-3H3,(H,30,31)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM50099667 (5-Methyl-4-oxo-hexanoic acid 3-carboxymethyl-1-(4-...) Show SMILES CC(C)C(=O)CCC(=O)Oc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1 Show InChI InChI=1S/C25H24ClNO6/c1-14(2)22(28)10-11-24(31)33-18-8-9-21-20(12-18)19(13-23(29)30)15(3)27(21)25(32)16-4-6-17(26)7-5-16/h4-9,12,14H,10-11,13H2,1-3H3,(H,29,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM50099673 (5-Methyl-hexanoic acid 3-carboxymethyl-1-(4-chloro...) Show SMILES CC(C)CCCC(=O)Oc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1 Show InChI InChI=1S/C25H26ClNO5/c1-15(2)5-4-6-24(30)32-19-11-12-22-21(13-19)20(14-23(28)29)16(3)27(22)25(31)17-7-9-18(26)10-8-17/h7-13,15H,4-6,14H2,1-3H3,(H,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM50099671 (CHEMBL48119 | Heptanoic acid 3-carboxymethyl-1-(4-...) Show SMILES CCCCCCC(=O)Oc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1 Show InChI InChI=1S/C25H26ClNO5/c1-3-4-5-6-7-24(30)32-19-12-13-22-21(14-19)20(15-23(28)29)16(2)27(22)25(31)17-8-10-18(26)11-9-17/h8-14H,3-7,15H2,1-2H3,(H,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM50029074 (2-{1-[(4-chlorophenyl)carbonyl]-5-hydroxy-2-methyl...) Show SMILES Cc1c(CC(O)=O)c2cc(O)ccc2n1C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C18H14ClNO4/c1-10-14(9-17(22)23)15-8-13(21)6-7-16(15)20(10)18(24)11-2-4-12(19)5-3-11/h2-8,21H,9H2,1H3,(H,22,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM50099674 (CHEMBL47836 | [1-(4-Chloro-benzoyl)-5-(2-hydroxy-e...) Show SMILES Cc1c(CC(O)=O)c2cc(OCCO)ccc2n1C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C20H18ClNO5/c1-12-16(11-19(24)25)17-10-15(27-9-8-23)6-7-18(17)22(12)20(26)13-2-4-14(21)5-3-13/h2-7,10,23H,8-9,11H2,1H3,(H,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM50099677 (CHEMBL417723 | [1-(4-Chloro-benzoyl)-5-(3-hydroxy-...) Show SMILES Cc1c(CC(O)=O)c2cc(OCCCO)ccc2n1C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H20ClNO5/c1-13-17(12-20(25)26)18-11-16(28-10-2-9-24)7-8-19(18)23(13)21(27)14-3-5-15(22)6-4-14/h3-8,11,24H,2,9-10,12H2,1H3,(H,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM17638 (2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...) Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1 Show InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM50099666 (CHEMBL48025 | {4-[3-(4-Fluoro-3-nitro-phenyl)-urei...) Show SMILES OC(=O)CNc1ccc(NC(=O)Nc2ccc(F)c(c2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C15H13FN4O5/c16-12-6-5-11(7-13(12)20(24)25)19-15(23)18-10-3-1-9(2-4-10)17-8-14(21)22/h1-7,17H,8H2,(H,21,22)(H2,18,19,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM50099676 (4-[(2-Amino-4-hydroxy-pteridin-6-ylmethyl)-(2,2,2-...) Show SMILES Nc1nc2ncc(CN(C(=O)C(F)(F)F)c3ccc(cc3)C(O)=O)nc2c(=O)[nH]1 Show InChI InChI=1S/C16H11F3N6O4/c17-16(18,19)14(29)25(9-3-1-7(2-4-9)13(27)28)6-8-5-21-11-10(22-8)12(26)24-15(20)23-11/h1-5H,6H2,(H,27,28)(H3,20,21,23,24,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	9.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM50099665 (6-amino-2-[(hydrazinocarbonyl)amino]-1,3-dioxo-2,3...) Show SMILES NNC(=O)NN1C(=O)c2cc(cc3c(N)c(cc(C1=O)c23)S(O)(=O)=O)S(O)(=O)=O Show InChI InChI=1S/C13H11N5O9S2/c14-10-5-1-4(28(22,23)24)2-6-9(5)7(3-8(10)29(25,26)27)12(20)18(11(6)19)17-13(21)16-15/h1-3H,14-15H2,(H2,16,17,21)(H,22,23,24)(H,25,26,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL MCE PC cid PC sid UniChem Patents	PubMed	n/a	n/a	1.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM50099678 (2-Bromo-5-methoxy-thiobenzoic acid S-[1-(3-chloro-...) Show SMILES COc1ccc(Br)c(c1)C(=O)Sc1nnnn1-c1cccc(Cl)c1 Show InChI InChI=1S/C15H10BrClN4O2S/c1-23-11-5-6-13(16)12(8-11)14(22)24-15-18-19-20-21(15)10-4-2-3-9(17)7-10/h2-8H,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM50099668 (3-(4-Bromo-2-chloro-phenylcarbamoyl)-acrylic acid ...) Show SMILES OC(=O)\C=C\C(=O)Nc1ccc(Br)cc1Cl Show InChI InChI=1S/C10H7BrClNO3/c11-6-1-2-8(7(12)5-6)13-9(14)3-4-10(15)16/h1-5H,(H,13,14)(H,15,16)/b4-3+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q] (Bos taurus (Cattle))	BDBM50099670 (2-(4-(4-aminophenylsulfonyl)phenylamino)acetic aci...) Show SMILES Nc1ccc(cc1)S(=O)(=O)c1ccc(NCC(O)=O)cc1 Show InChI InChI=1S/C14H14N2O4S/c15-10-1-5-12(6-2-10)21(19,20)13-7-3-11(4-8-13)16-9-14(17)18/h1-8,16H,9,15H2,(H,17,18)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL DrugBank PC cid PC sid UniChem Patents	PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of Aldose reductase (AR)				J Med Chem 44: 1718-28 (2001) BindingDB Entry DOI: 10.7270/Q2N0177X
					More data for this Ligand-Target Pair