Compile Data Set for Download or QSAR

Found 19 hits Enz. Inhib. hit(s) with Target = 'Major prion protein' AND taxid = 9940   

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
Major prion protein (Ovis aries)	BDBM50437258 (CHEMBL2407263) Show SMILES CC(C)N1CCN(CC1)c1ccc(NC(=O)c2ccc(cc2)-c2ccccn2)cc1F Show InChI InChI=1S/C25H27FN4O/c1-18(2)29-13-15-30(16-14-29)24-11-10-21(17-22(24)26)28-25(31)20-8-6-19(7-9-20)23-5-3-4-12-27-23/h3-12,17-18H,13-16H2,1-2H3,(H,28,31)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	334	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437274 (CHEMBL2407264) Show SMILES CCOc1cccc(c1)C(=O)Nc1ccc(cc1)N1CCN(C)CC1 Show InChI InChI=1S/C20H25N3O2/c1-3-25-19-6-4-5-16(15-19)20(24)21-17-7-9-18(10-8-17)23-13-11-22(2)12-14-23/h4-10,15H,3,11-14H2,1-2H3,(H,21,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437260 (CHEMBL2407261) Show SMILES CC(C)N1CCN(CC1)c1ccc(NC(=O)c2ccc(cc2)-c2ccccn2)cn1 Show InChI InChI=1S/C24H27N5O/c1-18(2)28-13-15-29(16-14-28)23-11-10-21(17-26-23)27-24(30)20-8-6-19(7-9-20)22-5-3-4-12-25-22/h3-12,17-18H,13-16H2,1-2H3,(H,27,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	677	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437261 (CHEMBL2407260) Show SMILES CC(C)N1CCN(CC1)c1ccc(NC(=O)c2ccc(cc2)-c2ccccn2)nc1 Show InChI InChI=1S/C24H27N5O/c1-18(2)28-13-15-29(16-14-28)21-10-11-23(26-17-21)27-24(30)20-8-6-19(7-9-20)22-5-3-4-12-25-22/h3-12,17-18H,13-16H2,1-2H3,(H,26,27,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	348	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437262 (CHEMBL2407259) Show SMILES CC(C)N1CCN(CC1)c1ccc(NC(=O)c2ccc(cc2)-c2ccccn2)cc1 Show InChI InChI=1S/C25H28N4O/c1-19(2)28-15-17-29(18-16-28)23-12-10-22(11-13-23)27-25(30)21-8-6-20(7-9-21)24-5-3-4-14-26-24/h3-14,19H,15-18H2,1-2H3,(H,27,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	165	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437263 (CHEMBL2407258) Show SMILES CCN1CCN(CC1)c1ccc(NC(=O)c2ccc(cc2)-c2ccncc2)cc1 Show InChI InChI=1S/C24H26N4O/c1-2-27-15-17-28(18-16-27)23-9-7-22(8-10-23)26-24(29)21-5-3-19(4-6-21)20-11-13-25-14-12-20/h3-14H,2,15-18H2,1H3,(H,26,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	743	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437264 (CHEMBL2407257) Show SMILES CCN1CCN(CC1)c1ccc(NC(=O)c2ccc(cc2)-c2cccnc2)cc1 Show InChI InChI=1S/C24H26N4O/c1-2-27-14-16-28(17-15-27)23-11-9-22(10-12-23)26-24(29)20-7-5-19(6-8-20)21-4-3-13-25-18-21/h3-13,18H,2,14-17H2,1H3,(H,26,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	243	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437265 (CHEMBL2407256) Show SMILES CCN1CCN(CC1)c1ccc(NC(=O)c2ccc(cc2)-c2ccccn2)cc1 Show InChI InChI=1S/C24H26N4O/c1-2-27-15-17-28(18-16-27)22-12-10-21(11-13-22)26-24(29)20-8-6-19(7-9-20)23-5-3-4-14-25-23/h3-14H,2,15-18H2,1H3,(H,26,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	365	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437266 (CHEMBL2407271) Show SMILES CC(C)N1CCN(CC1)c1ccc(NC(=O)c2ccc(cc2)-c2ccccc2)cc1 Show InChI InChI=1S/C26H29N3O/c1-20(2)28-16-18-29(19-17-28)25-14-12-24(13-15-25)27-26(30)23-10-8-22(9-11-23)21-6-4-3-5-7-21/h3-15,20H,16-19H2,1-2H3,(H,27,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	22	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437267 (CHEMBL2407270) Show SMILES CCN1CCN(CC1)c1ccc(NC(=O)c2ccc(cc2)-c2ccccc2)cc1 Show InChI InChI=1S/C25H27N3O/c1-2-27-16-18-28(19-17-27)24-14-12-23(13-15-24)26-25(29)22-10-8-21(9-11-22)20-6-4-3-5-7-20/h3-15H,2,16-19H2,1H3,(H,26,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	221	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437268 (CHEMBL2407269) Show SMILES CN1CCN(CC1)c1ccc(NC(=O)c2ccc(cc2)-c2ccccc2)cc1 Show InChI InChI=1S/C24H25N3O/c1-26-15-17-27(18-16-26)23-13-11-22(12-14-23)25-24(28)21-9-7-20(8-10-21)19-5-3-2-4-6-19/h2-14H,15-18H2,1H3,(H,25,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	520	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437269 (CHEMBL2407268) Show SMILES CC(=O)c1ccc(NC(=O)c2ccc(cc2)-c2ccccc2)cc1 Show InChI InChI=1S/C21H17NO2/c1-15(23)16-11-13-20(14-12-16)22-21(24)19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-14H,1H3,(H,22,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	861	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM75523 (3-Methoxy-naphthalene-2-carboxylic acid (4-ethoxy-...) Show SMILES CCOc1ccc(NC(=O)c2cc3ccccc3cc2OC)cc1 Show InChI InChI=1S/C20H19NO3/c1-3-24-17-10-8-16(9-11-17)21-20(22)18-12-14-6-4-5-7-15(14)13-19(18)23-2/h4-13H,3H2,1-2H3,(H,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	512	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM80521 (3-Hydroxy-2-naphtho-p-phenetidide | 3-hydroxy-N-p-...) Show SMILES CCOc1ccc(NC(=O)c2cc3ccccc3cc2O)cc1 Show InChI InChI=1S/C19H17NO3/c1-2-23-16-9-7-15(8-10-16)20-19(22)17-11-13-5-3-4-6-14(13)12-18(17)21/h3-12,21H,2H2,1H3,(H,20,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	212	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437270 (CHEMBL2407267) Show SMILES Clc1cccc(NC(=O)c2ccc(NC(=O)c3ccccc3)cc2)c1 Show InChI InChI=1S/C20H15ClN2O2/c21-16-7-4-8-18(13-16)23-20(25)15-9-11-17(12-10-15)22-19(24)14-5-2-1-3-6-14/h1-13H,(H,22,24)(H,23,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	424	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437271 (CHEMBL2407266) Show SMILES CCN(CC)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 Show InChI InChI=1S/C17H19BrN2O/c1-3-20(4-2)16-11-9-15(10-12-16)19-17(21)13-5-7-14(18)8-6-13/h5-12H,3-4H2,1-2H3,(H,19,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	6.66E+3	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437272 (CHEMBL2407265) Show SMILES CN1CCN(CC1)c1ccc(NC(=O)c2cccc(Br)c2)cc1 Show InChI InChI=1S/C18H20BrN3O/c1-21-9-11-22(12-10-21)17-7-5-16(6-8-17)20-18(23)14-3-2-4-15(19)13-14/h2-8,13H,9-12H2,1H3,(H,20,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437273 (CHEMBL1332508) Show SMILES COc1cccc(c1)C(=O)Nc1ccc(cc1)N1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C25H27N3O2/c1-30-24-9-5-8-21(18-24)25(29)26-22-10-12-23(13-11-22)28-16-14-27(15-17-28)19-20-6-3-2-4-7-20/h2-13,18H,14-17,19H2,1H3,(H,26,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair
Major prion protein (Ovis aries)	BDBM50437259 (CHEMBL2407262) Show SMILES CC(C)N1CCN(CC1)c1ccc(NC(=O)c2ccc(cc2)-c2ccccn2)c(F)c1 Show InChI InChI=1S/C25H27FN4O/c1-18(2)29-13-15-30(16-14-29)21-10-11-24(22(26)17-21)28-25(31)20-8-6-19(7-9-20)23-5-3-4-12-27-23/h3-12,17-18H,13-16H2,1-2H3,(H,28,31)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	411	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antiprion activity against sheep prion infected in mouse ScN2a-cl3 cells assessed as reduction in PrPSc level after 5 days by ELISA				ACS Med Chem Lett 4: 647-650 (2013) Article DOI: 10.1021/ml300454k BindingDB Entry DOI: 10.7270/Q26D5VCS
					More data for this Ligand-Target Pair