Compile Data Set for Download or QSAR

Found 6 hits Enz. Inhib. hit(s) with all data for entry = 50010592   

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 alpha type (Homo sapiens (Human))	BDBM50057509 ((2S,5S)-8-Dec-1-ynyl-5-hydroxymethyl-2-isopropyl-1...) Show SMILES CCCCCCCCC#Cc1ccc2N(C)[C@@H](C(C)C)C(=O)N[C@H](CO)Cc2c1 Show InChI InChI=1S/C25H38N2O2/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,5-11,17-18H2,1-4H3,(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	PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Organic Chemistry Curated by ChEMBL					Assay Description Displacement phorbol 12,13-dibutyrate(PDBU) binding from recombinant Protein kinase C alpha				Bioorg Med Chem Lett 11: 99-101 (2001) BindingDB Entry DOI: 10.7270/Q2XP745F
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50096601 ((2S,5S)-8-Dec-1-ynyl-5-hydroxymethyl-2-isopropyl-7...) Show SMILES CCCCCCCCC#Cc1ccc2N(C)[C@@H](C(C)C)C(=O)N[C@H](CO)Cc2c1OC Show InChI InChI=1S/C26H40N2O3/c1-6-7-8-9-10-11-12-13-14-20-15-16-23-22(25(20)31-5)17-21(18-29)27-26(30)24(19(2)3)28(23)4/h15-16,19,21,24,29H,6-12,17-18H2,1-5H3,(H,27,30)/t21-,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	PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Organic Chemistry Curated by ChEMBL					Assay Description Displacement phorbol 12,13-dibutyrate(PDBU) binding from recombinant Protein kinase C alpha				Bioorg Med Chem Lett 11: 99-101 (2001) BindingDB Entry DOI: 10.7270/Q2XP745F
					More data for this Ligand-Target Pair
Protein kinase C delta type (Homo sapiens (Human))	BDBM50096601 ((2S,5S)-8-Dec-1-ynyl-5-hydroxymethyl-2-isopropyl-7...) Show SMILES CCCCCCCCC#Cc1ccc2N(C)[C@@H](C(C)C)C(=O)N[C@H](CO)Cc2c1OC Show InChI InChI=1S/C26H40N2O3/c1-6-7-8-9-10-11-12-13-14-20-15-16-23-22(25(20)31-5)17-21(18-29)27-26(30)24(19(2)3)28(23)4/h15-16,19,21,24,29H,6-12,17-18H2,1-5H3,(H,27,30)/t21-,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	PubMed	91	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Organic Chemistry Curated by ChEMBL					Assay Description Binding affinity for protein kinase C delta				Bioorg Med Chem Lett 11: 99-101 (2001) BindingDB Entry DOI: 10.7270/Q2XP745F
					More data for this Ligand-Target Pair
Protein kinase C epsilon type (Homo sapiens (Human))	BDBM50096601 ((2S,5S)-8-Dec-1-ynyl-5-hydroxymethyl-2-isopropyl-7...) Show SMILES CCCCCCCCC#Cc1ccc2N(C)[C@@H](C(C)C)C(=O)N[C@H](CO)Cc2c1OC Show InChI InChI=1S/C26H40N2O3/c1-6-7-8-9-10-11-12-13-14-20-15-16-23-22(25(20)31-5)17-21(18-29)27-26(30)24(19(2)3)28(23)4/h15-16,19,21,24,29H,6-12,17-18H2,1-5H3,(H,27,30)/t21-,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	PubMed	121	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Organic Chemistry Curated by ChEMBL					Assay Description Binding affinity for protein kinase C epsilon				Bioorg Med Chem Lett 11: 99-101 (2001) BindingDB Entry DOI: 10.7270/Q2XP745F
					More data for this Ligand-Target Pair
Protein kinase C alpha 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	PubMed	334	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Organic Chemistry Curated by ChEMBL					Assay Description Displacement phorbol 12,13-dibutyrate(PDBU) binding from recombinant Protein kinase C alpha				Bioorg Med Chem Lett 11: 99-101 (2001) BindingDB Entry DOI: 10.7270/Q2XP745F
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50096602 ((2S,5S)-5-Hydroxymethyl-2-isopropyl-7-methoxy-1-me...) Show SMILES COc1cccc2N(C)[C@@H](C(C)C)C(=O)N[C@H](CO)Cc12 Show InChI InChI=1S/C16H24N2O3/c1-10(2)15-16(20)17-11(9-19)8-12-13(18(15)3)6-5-7-14(12)21-4/h5-7,10-11,15,19H,8-9H2,1-4H3,(H,17,20)/t11-,15-/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	7.16E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Organic Chemistry Curated by ChEMBL					Assay Description Displacement phorbol 12,13-dibutyrate(PDBU) binding from recombinant Protein kinase C alpha				Bioorg Med Chem Lett 11: 99-101 (2001) BindingDB Entry DOI: 10.7270/Q2XP745F
					More data for this Ligand-Target Pair