Compile Data Set for Download or QSAR

Found 50 hits Enz. Inhib. hit(s) with all data for entry = 50004525   

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
Presenilin-1 (Homo sapiens (Human))	BDBM50483746 (CHEMBL1770758) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(CC)CC |r| Show InChI InChI=1S/C21H28F2N4O2/c1-4-7-18(25-20(28)10-14-8-15(22)11-16(23)9-14)21(29)26-19-12-27(13-24-19)17(5-2)6-3/h8-9,11-13,17-18H,4-7,10H2,1-3H3,(H,25,28)(H,26,29)/t18-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.390	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483742 (CHEMBL1770898) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CNCC(C)(C)C |r| Show InChI InChI=1S/C25H37F2N5O2/c1-7-8-20(30-22(33)11-17-9-18(26)12-19(27)10-17)23(34)31-21-13-32(16-29-21)25(5,6)15-28-14-24(2,3)4/h9-10,12-13,16,20,28H,7-8,11,14-15H2,1-6H3,(H,30,33)(H,31,34)/t20-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.400	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483760 (CHEMBL1770893) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCOCC1 |r| Show InChI InChI=1S/C24H33F2N5O3/c1-4-5-20(28-22(32)12-17-10-18(25)13-19(26)11-17)23(33)29-21-14-31(16-27-21)24(2,3)15-30-6-8-34-9-7-30/h10-11,13-14,16,20H,4-9,12,15H2,1-3H3,(H,28,32)(H,29,33)/t20-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.400	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483743 (CHEMBL1770899) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CNCC1CCOCC1 |r| Show InChI InChI=1S/C26H37F2N5O3/c1-4-5-22(31-24(34)12-19-10-20(27)13-21(28)11-19)25(35)32-23-15-33(17-30-23)26(2,3)16-29-14-18-6-8-36-9-7-18/h10-11,13,15,17-18,22,29H,4-9,12,14,16H2,1-3H3,(H,31,34)(H,32,35)/t22-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.400	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483743 (CHEMBL1770899) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CNCC1CCOCC1 |r| Show InChI InChI=1S/C26H37F2N5O3/c1-4-5-22(31-24(34)12-19-10-20(27)13-21(28)11-19)25(35)32-23-15-33(17-30-23)26(2,3)16-29-14-18-6-8-36-9-7-18/h10-11,13,15,17-18,22,29H,4-9,12,14,16H2,1-3H3,(H,31,34)(H,32,35)/t22-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.5	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483760 (CHEMBL1770893) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCOCC1 |r| Show InChI InChI=1S/C24H33F2N5O3/c1-4-5-20(28-22(32)12-17-10-18(25)13-19(26)11-17)23(33)29-21-14-31(16-27-21)24(2,3)15-30-6-8-34-9-7-30/h10-11,13-14,16,20H,4-9,12,15H2,1-3H3,(H,28,32)(H,29,33)/t20-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483756 (CHEMBL1770885) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCCC1 |r| Show InChI InChI=1S/C24H33F2N5O2/c1-4-7-20(28-22(32)12-17-10-18(25)13-19(26)11-17)23(33)29-21-14-31(16-27-21)24(2,3)15-30-8-5-6-9-30/h10-11,13-14,16,20H,4-9,12,15H2,1-3H3,(H,28,32)(H,29,33)/t20-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.800	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483756 (CHEMBL1770885) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCCC1 |r| Show InChI InChI=1S/C24H33F2N5O2/c1-4-7-20(28-22(32)12-17-10-18(25)13-19(26)11-17)23(33)29-21-14-31(16-27-21)24(2,3)15-30-8-5-6-9-30/h10-11,13-14,16,20H,4-9,12,15H2,1-3H3,(H,28,32)(H,29,33)/t20-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.900	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483742 (CHEMBL1770898) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CNCC(C)(C)C |r| Show InChI InChI=1S/C25H37F2N5O2/c1-7-8-20(30-22(33)11-17-9-18(26)12-19(27)10-17)23(34)31-21-13-32(16-29-21)25(5,6)15-28-14-24(2,3)4/h9-10,12-13,16,20,28H,7-8,11,14-15H2,1-6H3,(H,30,33)(H,31,34)/t20-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483759 (CHEMBL1770760) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CC(=O)OC |r| Show InChI InChI=1S/C22H28F2N4O4/c1-5-6-17(26-19(29)9-14-7-15(23)10-16(24)8-14)21(31)27-18-12-28(13-25-18)22(2,3)11-20(30)32-4/h7-8,10,12-13,17H,5-6,9,11H2,1-4H3,(H,26,29)(H,27,31)/t17-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483759 (CHEMBL1770760) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CC(=O)OC |r| Show InChI InChI=1S/C22H28F2N4O4/c1-5-6-17(26-19(29)9-14-7-15(23)10-16(24)8-14)21(31)27-18-12-28(13-25-18)22(2,3)11-20(30)32-4/h7-8,10,12-13,17H,5-6,9,11H2,1-4H3,(H,26,29)(H,27,31)/t17-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483753 (CHEMBL1770897) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CNCc1ccccc1 |r| Show InChI InChI=1S/C27H33F2N5O2/c1-4-8-23(32-25(35)13-20-11-21(28)14-22(29)12-20)26(36)33-24-16-34(18-31-24)27(2,3)17-30-15-19-9-6-5-7-10-19/h5-7,9-12,14,16,18,23,30H,4,8,13,15,17H2,1-3H3,(H,32,35)(H,33,36)/t23-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483746 (CHEMBL1770758) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(CC)CC |r| Show InChI InChI=1S/C21H28F2N4O2/c1-4-7-18(25-20(28)10-14-8-15(22)11-16(23)9-14)21(29)26-19-12-27(13-24-19)17(5-2)6-3/h8-9,11-13,17-18H,4-7,10H2,1-3H3,(H,25,28)(H,26,29)/t18-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.40	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483755 (CHEMBL1770761) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CO |r| Show InChI InChI=1S/C20H26F2N4O3/c1-4-5-16(24-18(28)8-13-6-14(21)9-15(22)7-13)19(29)25-17-10-26(12-23-17)20(2,3)11-27/h6-7,9-10,12,16,27H,4-5,8,11H2,1-3H3,(H,24,28)(H,25,29)/t16-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483736 (CHEMBL1770888) Show SMILES CC[C@@H](C)[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCCC1 |r| Show InChI InChI=1S/C25H35F2N5O2/c1-5-17(2)23(30-22(33)12-18-10-19(26)13-20(27)11-18)24(34)29-21-14-32(16-28-21)25(3,4)15-31-8-6-7-9-31/h10-11,13-14,16-17,23H,5-9,12,15H2,1-4H3,(H,29,34)(H,30,33)/t17-,23+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483754 (CHEMBL1770759) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)C(=O)OC |r| Show InChI InChI=1S/C21H26F2N4O4/c1-5-6-16(25-18(28)9-13-7-14(22)10-15(23)8-13)19(29)26-17-11-27(12-24-17)21(2,3)20(30)31-4/h7-8,10-12,16H,5-6,9H2,1-4H3,(H,25,28)(H,26,29)/t16-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483753 (CHEMBL1770897) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CNCc1ccccc1 |r| Show InChI InChI=1S/C27H33F2N5O2/c1-4-8-23(32-25(35)13-20-11-21(28)14-22(29)12-20)26(36)33-24-16-34(18-31-24)27(2,3)17-30-15-19-9-6-5-7-10-19/h5-7,9-12,14,16,18,23,30H,4,8,13,15,17H2,1-3H3,(H,32,35)(H,33,36)/t23-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483747 (CHEMBL1770883) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CCO |r| Show InChI InChI=1S/C21H28F2N4O3/c1-4-5-17(25-19(29)10-14-8-15(22)11-16(23)9-14)20(30)26-18-12-27(13-24-18)21(2,3)6-7-28/h8-9,11-13,17,28H,4-7,10H2,1-3H3,(H,25,29)(H,26,30)/t17-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.60	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483752 (CHEMBL1770159) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN(C)C |r| Show InChI InChI=1S/C22H31F2N5O2/c1-6-7-18(26-20(30)10-15-8-16(23)11-17(24)9-15)21(31)27-19-12-29(14-25-19)22(2,3)13-28(4)5/h8-9,11-12,14,18H,6-7,10,13H2,1-5H3,(H,26,30)(H,27,31)/t18-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.80	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483750 (CHEMBL1770887) Show SMILES CC(C)C[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCCC1 |r| Show InChI InChI=1S/C25H35F2N5O2/c1-17(2)9-21(29-23(33)12-18-10-19(26)13-20(27)11-18)24(34)30-22-14-32(16-28-22)25(3,4)15-31-7-5-6-8-31/h10-11,13-14,16-17,21H,5-9,12,15H2,1-4H3,(H,29,33)(H,30,34)/t21-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.30	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483752 (CHEMBL1770159) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN(C)C |r| Show InChI InChI=1S/C22H31F2N5O2/c1-6-7-18(26-20(30)10-15-8-16(23)11-17(24)9-15)21(31)27-19-12-29(14-25-19)22(2,3)13-28(4)5/h8-9,11-12,14,18H,6-7,10,13H2,1-5H3,(H,26,30)(H,27,31)/t18-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.80	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483754 (CHEMBL1770759) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)C(=O)OC |r| Show InChI InChI=1S/C21H26F2N4O4/c1-5-6-16(25-18(28)9-13-7-14(22)10-15(23)8-13)19(29)26-17-11-27(12-24-17)21(2,3)20(30)31-4/h7-8,10-12,16H,5-6,9H2,1-4H3,(H,25,28)(H,26,29)/t16-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.10	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483750 (CHEMBL1770887) Show SMILES CC(C)C[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCCC1 |r| Show InChI InChI=1S/C25H35F2N5O2/c1-17(2)9-21(29-23(33)12-18-10-19(26)13-20(27)11-18)24(34)30-22-14-32(16-28-22)25(3,4)15-31-7-5-6-8-31/h10-11,13-14,16-17,21H,5-9,12,15H2,1-4H3,(H,29,33)(H,30,34)/t21-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483749 (CHEMBL1770886) Show SMILES C[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCCC1 |r| Show InChI InChI=1S/C22H29F2N5O2/c1-15(26-20(30)10-16-8-17(23)11-18(24)9-16)21(31)27-19-12-29(14-25-19)22(2,3)13-28-6-4-5-7-28/h8-9,11-12,14-15H,4-7,10,13H2,1-3H3,(H,26,30)(H,27,31)/t15-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.80	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483740 (CHEMBL1770895) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CNC(C)C |r| Show InChI InChI=1S/C23H33F2N5O2/c1-6-7-19(28-21(31)10-16-8-17(24)11-18(25)9-16)22(32)29-20-12-30(14-27-20)23(4,5)13-26-15(2)3/h8-9,11-12,14-15,19,26H,6-7,10,13H2,1-5H3,(H,28,31)(H,29,32)/t19-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.90	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483738 (CHEMBL1770891) Show SMILES COC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCCC1 |r| Show InChI InChI=1S/C23H31F2N5O3/c1-23(2,14-29-6-4-5-7-29)30-12-20(26-15-30)28-22(32)19(13-33-3)27-21(31)10-16-8-17(24)11-18(25)9-16/h8-9,11-12,15,19H,4-7,10,13-14H2,1-3H3,(H,27,31)(H,28,32)/t19-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.20	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483748 (CHEMBL1770884) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CCN1CCCC1 |r| Show InChI InChI=1S/C25H35F2N5O2/c1-4-7-21(29-23(33)14-18-12-19(26)15-20(27)13-18)24(34)30-22-16-32(17-28-22)25(2,3)8-11-31-9-5-6-10-31/h12-13,15-17,21H,4-11,14H2,1-3H3,(H,29,33)(H,30,34)/t21-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.10	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483757 (CHEMBL1770890) Show SMILES CC(C)(CN1CCCC1)n1cnc(NC(=O)[C@@H](NC(=O)Cc2cc(F)cc(F)c2)c2ccccc2)c1 |r| Show InChI InChI=1S/C27H31F2N5O2/c1-27(2,17-33-10-6-7-11-33)34-16-23(30-18-34)31-26(36)25(20-8-4-3-5-9-20)32-24(35)14-19-12-21(28)15-22(29)13-19/h3-5,8-9,12-13,15-16,18,25H,6-7,10-11,14,17H2,1-2H3,(H,31,36)(H,32,35)/t25-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.40	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483736 (CHEMBL1770888) Show SMILES CC[C@@H](C)[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCCC1 |r| Show InChI InChI=1S/C25H35F2N5O2/c1-5-17(2)23(30-22(33)12-18-10-19(26)13-20(27)11-18)24(34)29-21-14-32(16-28-21)25(3,4)15-31-8-6-7-9-31/h10-11,13-14,16-17,23H,5-9,12,15H2,1-4H3,(H,29,34)(H,30,33)/t17-,23+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483749 (CHEMBL1770886) Show SMILES C[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCCC1 |r| Show InChI InChI=1S/C22H29F2N5O2/c1-15(26-20(30)10-16-8-17(23)11-18(24)9-16)21(31)27-19-12-29(14-25-19)22(2,3)13-28-6-4-5-7-28/h8-9,11-12,14-15H,4-7,10,13H2,1-3H3,(H,26,30)(H,27,31)/t15-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483755 (CHEMBL1770761) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CO |r| Show InChI InChI=1S/C20H26F2N4O3/c1-4-5-16(24-18(28)8-13-6-14(21)9-15(22)7-13)19(29)25-17-10-26(12-23-17)20(2,3)11-27/h6-7,9-10,12,16,27H,4-5,8,11H2,1-3H3,(H,24,28)(H,25,29)/t16-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483747 (CHEMBL1770883) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CCO |r| Show InChI InChI=1S/C21H28F2N4O3/c1-4-5-17(25-19(29)10-14-8-15(22)11-16(23)9-14)20(30)26-18-12-27(13-24-18)21(2,3)6-7-28/h8-9,11-13,17,28H,4-7,10H2,1-3H3,(H,25,29)(H,26,30)/t17-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483737 (CHEMBL1770889) Show SMILES CC(C)(CN1CCCC1)n1cnc(NC(=O)[C@@H](NC(=O)Cc2cc(F)cc(F)c2)C2CCCCC2)c1 |r| Show InChI InChI=1S/C27H37F2N5O2/c1-27(2,17-33-10-6-7-11-33)34-16-23(30-18-34)31-26(36)25(20-8-4-3-5-9-20)32-24(35)14-19-12-21(28)15-22(29)13-19/h12-13,15-16,18,20,25H,3-11,14,17H2,1-2H3,(H,31,36)(H,32,35)/t25-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483740 (CHEMBL1770895) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CNC(C)C |r| Show InChI InChI=1S/C23H33F2N5O2/c1-6-7-19(28-21(31)10-16-8-17(24)11-18(25)9-16)22(32)29-20-12-30(14-27-20)23(4,5)13-26-15(2)3/h8-9,11-12,14-15,19,26H,6-7,10,13H2,1-5H3,(H,28,31)(H,29,32)/t19-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483738 (CHEMBL1770891) Show SMILES COC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCCC1 |r| Show InChI InChI=1S/C23H31F2N5O3/c1-23(2,14-29-6-4-5-7-29)30-12-20(26-15-30)28-22(32)19(13-33-3)27-21(31)10-16-8-17(24)11-18(25)9-16/h8-9,11-12,15,19H,4-7,10,13-14H2,1-3H3,(H,27,31)(H,28,32)/t19-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483751 (CHEMBL1770894) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CNC |r| Show InChI InChI=1S/C21H29F2N5O2/c1-5-6-17(26-19(29)9-14-7-15(22)10-16(23)8-14)20(30)27-18-11-28(13-25-18)21(2,3)12-24-4/h7-8,10-11,13,17,24H,5-6,9,12H2,1-4H3,(H,26,29)(H,27,30)/t17-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD 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
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483757 (CHEMBL1770890) Show SMILES CC(C)(CN1CCCC1)n1cnc(NC(=O)[C@@H](NC(=O)Cc2cc(F)cc(F)c2)c2ccccc2)c1 |r| Show InChI InChI=1S/C27H31F2N5O2/c1-27(2,17-33-10-6-7-11-33)34-16-23(30-18-34)31-26(36)25(20-8-4-3-5-9-20)32-24(35)14-19-12-21(28)15-22(29)13-19/h3-5,8-9,12-13,15-16,18,25H,6-7,10-11,14,17H2,1-2H3,(H,31,36)(H,32,35)/t25-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483745 (CHEMBL1770757) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(CCN2CCCC2)cn1 |r| Show InChI InChI=1S/C22H29F2N5O2/c1-2-5-19(26-21(30)12-16-10-17(23)13-18(24)11-16)22(31)27-20-14-29(15-25-20)9-8-28-6-3-4-7-28/h10-11,13-15,19H,2-9,12H2,1H3,(H,26,30)(H,27,31)/t19-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	53	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483737 (CHEMBL1770889) Show SMILES CC(C)(CN1CCCC1)n1cnc(NC(=O)[C@@H](NC(=O)Cc2cc(F)cc(F)c2)C2CCCCC2)c1 |r| Show InChI InChI=1S/C27H37F2N5O2/c1-27(2,17-33-10-6-7-11-33)34-16-23(30-18-34)31-26(36)25(20-8-4-3-5-9-20)32-24(35)14-19-12-21(28)15-22(29)13-19/h12-13,15-16,18,20,25H,3-11,14,17H2,1-2H3,(H,31,36)(H,32,35)/t25-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483744 (CHEMBL1770755) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(CC(=O)OC)cn1 |r| Show InChI InChI=1S/C19H22F2N4O4/c1-3-4-15(23-17(26)7-12-5-13(20)8-14(21)6-12)19(28)24-16-9-25(11-22-16)10-18(27)29-2/h5-6,8-9,11,15H,3-4,7,10H2,1-2H3,(H,23,26)(H,24,28)/t15-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	58	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483741 (CHEMBL1770896) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CNC1CCC(O)CC1 |r,wD:3.2,(1.85,-45.75,;1.84,-44.21,;.5,-43.44,;.5,-41.9,;-.84,-41.14,;-2.17,-41.91,;-2.16,-43.45,;-3.51,-41.15,;-4.84,-41.92,;-6.17,-41.16,;-7.5,-41.93,;-8.83,-41.16,;-7.5,-43.47,;-6.17,-44.25,;-6.17,-45.79,;-4.83,-43.47,;1.83,-41.13,;1.82,-39.59,;3.17,-41.89,;4.5,-41.12,;5.9,-41.74,;6.93,-40.59,;6.15,-39.26,;4.65,-39.59,;8.25,-39.81,;7.47,-38.48,;9.34,-38.72,;9.59,-40.57,;10.92,-39.79,;10.9,-38.26,;12.22,-37.48,;12.2,-35.96,;10.87,-35.2,;10.85,-33.66,;9.55,-35.98,;9.56,-37.52,)| Show InChI InChI=1S/C26H37F2N5O3/c1-4-5-22(31-24(35)12-17-10-18(27)13-19(28)11-17)25(36)32-23-14-33(16-30-23)26(2,3)15-29-20-6-8-21(34)9-7-20/h10-11,13-14,16,20-22,29,34H,4-9,12,15H2,1-3H3,(H,31,35)(H,32,36)/t20?,21?,22-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483741 (CHEMBL1770896) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CNC1CCC(O)CC1 |r,wD:3.2,(1.85,-45.75,;1.84,-44.21,;.5,-43.44,;.5,-41.9,;-.84,-41.14,;-2.17,-41.91,;-2.16,-43.45,;-3.51,-41.15,;-4.84,-41.92,;-6.17,-41.16,;-7.5,-41.93,;-8.83,-41.16,;-7.5,-43.47,;-6.17,-44.25,;-6.17,-45.79,;-4.83,-43.47,;1.83,-41.13,;1.82,-39.59,;3.17,-41.89,;4.5,-41.12,;5.9,-41.74,;6.93,-40.59,;6.15,-39.26,;4.65,-39.59,;8.25,-39.81,;7.47,-38.48,;9.34,-38.72,;9.59,-40.57,;10.92,-39.79,;10.9,-38.26,;12.22,-37.48,;12.2,-35.96,;10.87,-35.2,;10.85,-33.66,;9.55,-35.98,;9.56,-37.52,)| Show InChI InChI=1S/C26H37F2N5O3/c1-4-5-22(31-24(35)12-17-10-18(27)13-19(28)11-17)25(36)32-23-14-33(16-30-23)26(2,3)15-29-20-6-8-21(34)9-7-20/h10-11,13-14,16,20-22,29,34H,4-9,12,15H2,1-3H3,(H,31,35)(H,32,36)/t20?,21?,22-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	73	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483758 (CHEMBL1770756) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(CCO)cn1 |r| Show InChI InChI=1S/C18H22F2N4O3/c1-2-3-15(18(27)23-16-10-24(4-5-25)11-21-16)22-17(26)8-12-6-13(19)9-14(20)7-12/h6-7,9-11,15,25H,2-5,8H2,1H3,(H,22,26)(H,23,27)/t15-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD 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
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483751 (CHEMBL1770894) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CNC |r| Show InChI InChI=1S/C21H29F2N5O2/c1-5-6-17(26-19(29)9-14-7-15(22)10-16(23)8-14)20(30)27-18-11-28(13-25-18)21(2,3)12-24-4/h7-8,10-11,13,17,24H,5-6,9,12H2,1-4H3,(H,26,29)(H,27,30)/t17-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483745 (CHEMBL1770757) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(CCN2CCCC2)cn1 |r| Show InChI InChI=1S/C22H29F2N5O2/c1-2-5-19(26-21(30)12-16-10-17(23)13-18(24)11-16)22(31)27-20-14-29(15-25-20)9-8-28-6-3-4-7-28/h10-11,13-15,19H,2-9,12H2,1H3,(H,26,30)(H,27,31)/t19-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	114	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483748 (CHEMBL1770884) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CCN1CCCC1 |r| Show InChI InChI=1S/C25H35F2N5O2/c1-4-7-21(29-23(33)14-18-12-19(26)15-20(27)13-18)24(34)30-22-16-32(17-28-22)25(2,3)8-11-31-9-5-6-10-31/h12-13,15-17,21H,4-11,14H2,1-3H3,(H,29,33)(H,30,34)/t21-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	226	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483744 (CHEMBL1770755) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(CC(=O)OC)cn1 |r| Show InChI InChI=1S/C19H22F2N4O4/c1-3-4-15(23-17(26)7-12-5-13(20)8-14(21)6-12)19(28)24-16-9-25(11-22-16)10-18(27)29-2/h5-6,8-9,11,15H,3-4,7,10H2,1-2H3,(H,23,26)(H,24,28)/t15-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	263	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483758 (CHEMBL1770756) Show SMILES CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(CCO)cn1 |r| Show InChI InChI=1S/C18H22F2N4O3/c1-2-3-15(18(27)23-16-10-24(4-5-25)11-21-16)22-17(26)8-12-6-13(19)9-14(20)7-12/h6-7,9-11,15,25H,2-5,8H2,1H3,(H,22,26)(H,23,27)/t15-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	306	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483739 (CHEMBL1770892) Show SMILES CN(C)C(=O)C[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCCC1 |r| Show InChI InChI=1S/C25H34F2N6O3/c1-25(2,15-32-7-5-6-8-32)33-14-21(28-16-33)30-24(36)20(13-23(35)31(3)4)29-22(34)11-17-9-18(26)12-19(27)10-17/h9-10,12,14,16,20H,5-8,11,13,15H2,1-4H3,(H,29,34)(H,30,36)/t20-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483739 (CHEMBL1770892) Show SMILES CN(C)C(=O)C[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCCC1 |r| Show InChI InChI=1S/C25H34F2N6O3/c1-25(2,15-32-7-5-6-8-32)33-14-21(28-16-33)30-24(36)20(13-23(35)31(3)4)29-22(34)11-17-9-18(26)12-19(27)10-17/h9-10,12,14,16,20H,5-8,11,13,15H2,1-4H3,(H,29,34)(H,30,36)/t20-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2631-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.117 BindingDB Entry DOI: 10.7270/Q2K64MX1
					More data for this Ligand-Target Pair