Compile Data Set for Download or QSAR
Found 37 Enz. Inhib. hit(s) with all data for entry = 50011276
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546132(CHEMBL4759048)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)N(C[C@H](O)[C@@H](N)c1ccc(OC(F)(F)F)cc1)C1CCC1
Show InChI InChI=1S/C24H31F3N2O4S/c1-23(2,3)17-9-13-20(14-10-17)34(31,32)29(18-5-4-6-18)15-21(30)22(28)16-7-11-19(12-8-16)33-24(25,26)27/h7-14,18,21-22,30H,4-6,15,28H2,1-3H3/t21-,22-/m0/s1
Affinity DataIC50: 4nMAssay Description:Inhibition of SPPL2a in human U2OS cells cotransfected with EGFP-labeled TNFalpha (1 to 76 residues)-NTF incubated for 24 hrs by Hoechst staining bas...More data for this Ligand-Target Pair
TargetSignal peptide peptidase-like 2A(Mus musculus)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546132(CHEMBL4759048)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)N(C[C@H](O)[C@@H](N)c1ccc(OC(F)(F)F)cc1)C1CCC1
Show InChI InChI=1S/C24H31F3N2O4S/c1-23(2,3)17-9-13-20(14-10-17)34(31,32)29(18-5-4-6-18)15-21(30)22(28)16-7-11-19(12-8-16)33-24(25,26)27/h7-14,18,21-22,30H,4-6,15,28H2,1-3H3/t21-,22-/m0/s1
Affinity DataIC50: 5nMAssay Description:Inhibition of mouse SPPL2a cotransfected with EGFP-NLP-fused TNFalpha (1 to 77 residues)-NTF incubated for 24 hrs by Hoechst staining based Cellomics...More data for this Ligand-Target Pair
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546130(CHEMBL4762492)
Show SMILES CC(C)(C)c1cccc(c1)S(=O)(=O)N(C[C@H](O)[C@@H](N)c1ccccc1)C1CCC1
Show InChI InChI=1S/C23H32N2O3S/c1-23(2,3)18-11-7-14-20(15-18)29(27,28)25(19-12-8-13-19)16-21(26)22(24)17-9-5-4-6-10-17/h4-7,9-11,14-15,19,21-22,26H,8,12-13,16,24H2,1-3H3/t21-,22-/m0/s1
Affinity DataIC50: 7nMAssay Description:Inhibition of human SPPL2a expressed in HEK293 cells cotransfected with Gal4 luciferase reporter plasmid and VP16-TNFalpha(1-76)-NTF incubated for 24...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546132(CHEMBL4759048)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)N(C[C@H](O)[C@@H](N)c1ccc(OC(F)(F)F)cc1)C1CCC1
Show InChI InChI=1S/C24H31F3N2O4S/c1-23(2,3)17-9-13-20(14-10-17)34(31,32)29(18-5-4-6-18)15-21(30)22(28)16-7-11-19(12-8-16)33-24(25,26)27/h7-14,18,21-22,30H,4-6,15,28H2,1-3H3/t21-,22-/m0/s1
Affinity DataIC50: 9nMAssay Description:Inhibition of human SPPL2a expressed in HEK293 cells cotransfected with Gal4 luciferase reporter plasmid and VP16-TNFalpha(1-76)-NTF incubated for 24...More data for this Ligand-Target Pair
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546128(CHEMBL4753654)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)S(=O)(=O)N(C[C@H](O)[C@@H](N)c1ccccc1)C1CCC1
Show InChI InChI=1S/C27H38N2O3S/c1-26(2)15-16-27(3,4)23-17-21(13-14-22(23)26)33(31,32)29(20-11-8-12-20)18-24(30)25(28)19-9-6-5-7-10-19/h5-7,9-10,13-14,17,20,24-25,30H,8,11-12,15-16,18,28H2,1-4H3/t24-,25-/m0/s1
Affinity DataIC50: 13nMAssay Description:Inhibition of human SPPL2a expressed in HEK293 cells cotransfected with Gal4 luciferase reporter plasmid and VP16-TNFalpha(1-76)-NTF incubated for 24...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546125(CHEMBL4792187)
Show SMILES N[C@H]([C@@H](O)CN(C1CCCCCC1)S(=O)(=O)c1ccc(Cl)c(Cl)c1)c1ccccc1
Show InChI InChI=1S/C22H28Cl2N2O3S/c23-19-13-12-18(14-20(19)24)30(28,29)26(17-10-6-1-2-7-11-17)15-21(27)22(25)16-8-4-3-5-9-16/h3-5,8-9,12-14,17,21-22,27H,1-2,6-7,10-11,15,25H2/t21-,22-/m0/s1
Affinity DataIC50: 15nMAssay Description:Inhibition of human SPPL2a expressed in HEK293 cells cotransfected with Gal4 luciferase reporter plasmid and VP16-TNFalpha(1-76)-NTF incubated for 24...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546131(CHEMBL4759943)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)N(C[C@H](O)[C@@H](N)c1ccccc1)C1CCC1
Show InChI InChI=1S/C23H32N2O3S/c1-23(2,3)18-12-14-20(15-13-18)29(27,28)25(19-10-7-11-19)16-21(26)22(24)17-8-5-4-6-9-17/h4-6,8-9,12-15,19,21-22,26H,7,10-11,16,24H2,1-3H3/t21-,22-/m0/s1
Affinity DataIC50: 25nMAssay Description:Inhibition of human SPPL2a expressed in HEK293 cells cotransfected with Gal4 luciferase reporter plasmid and VP16-TNFalpha(1-76)-NTF incubated for 24...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546124(CHEMBL4740837)
Show SMILES N[C@H]([C@@H](O)CN(C1CCC1)S(=O)(=O)c1ccc(Cl)c(Cl)c1)c1ccccc1
Show InChI InChI=1S/C19H22Cl2N2O3S/c20-16-10-9-15(11-17(16)21)27(25,26)23(14-7-4-8-14)12-18(24)19(22)13-5-2-1-3-6-13/h1-3,5-6,9-11,14,18-19,24H,4,7-8,12,22H2/t18-,19-/m0/s1
Affinity DataIC50: 88nMAssay Description:Inhibition of human SPPL2a expressed in HEK293 cells cotransfected with Gal4 luciferase reporter plasmid and VP16-TNFalpha(1-76)-NTF incubated for 24...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetSignal peptide peptidase-like 2A(Mus musculus)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546132(CHEMBL4759048)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)N(C[C@H](O)[C@@H](N)c1ccc(OC(F)(F)F)cc1)C1CCC1
Show InChI InChI=1S/C24H31F3N2O4S/c1-23(2,3)17-9-13-20(14-10-17)34(31,32)29(18-5-4-6-18)15-21(30)22(28)16-7-11-19(12-8-16)33-24(25,26)27/h7-14,18,21-22,30H,4-6,15,28H2,1-3H3/t21-,22-/m0/s1
Affinity DataIC50: 150nMAssay Description:Inhibition of SPPL2a in Balb/c mouse A20 cells assessed as reduction in CD74/p8 NTF accumulation incubated for overnight by Western blot analysisMore data for this Ligand-Target Pair
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546118(CHEMBL4762370)
Show SMILES CC(C)CN(C[C@H](O)[C@@H](N)c1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H24Cl2N2O3S/c1-13(2)11-23(12-18(24)19(22)14-6-4-3-5-7-14)27(25,26)15-8-9-16(20)17(21)10-15/h3-10,13,18-19,24H,11-12,22H2,1-2H3/t18-,19-/m0/s1
Affinity DataIC50: 200nMAssay Description:Inhibition of human SPPL2a expressed in HEK293 cells cotransfected with Gal4 luciferase reporter plasmid and VP16-TNFalpha(1-76)-NTF incubated for 24...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetSignal peptide peptidase-like 2B(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546132(CHEMBL4759048)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)N(C[C@H](O)[C@@H](N)c1ccc(OC(F)(F)F)cc1)C1CCC1
Show InChI InChI=1S/C24H31F3N2O4S/c1-23(2,3)17-9-13-20(14-10-17)34(31,32)29(18-5-4-6-18)15-21(30)22(28)16-7-11-19(12-8-16)33-24(25,26)27/h7-14,18,21-22,30H,4-6,15,28H2,1-3H3/t21-,22-/m0/s1
Affinity DataIC50: 270nMAssay Description:Inhibition of SPPL2b in human U2OS cells cotransfected with EGFP-labeled TNFalpha (1 to 76 residues)-NTF incubated for 24 hrs by Hoechst staining bas...More data for this Ligand-Target Pair
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546122(CHEMBL4747630)
Show SMILES CC(C)ON(C[C@H](O)[C@@H](N)c1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C18H22Cl2N2O4S/c1-12(2)26-22(11-17(23)18(21)13-6-4-3-5-7-13)27(24,25)14-8-9-15(19)16(20)10-14/h3-10,12,17-18,23H,11,21H2,1-2H3/t17-,18-/m0/s1
Affinity DataIC50: 350nMAssay Description:Inhibition of human SPPL2a expressed in HEK293 cells cotransfected with Gal4 luciferase reporter plasmid and VP16-TNFalpha(1-76)-NTF incubated for 24...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546123(CHEMBL4789381)
Show SMILES N[C@H]([C@@H](O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1)c1ccccc1
Show InChI InChI=1S/C22H22Cl2N2O3S/c23-19-12-11-18(13-20(19)24)30(28,29)26(14-16-7-3-1-4-8-16)15-21(27)22(25)17-9-5-2-6-10-17/h1-13,21-22,27H,14-15,25H2/t21-,22-/m0/s1
Affinity DataIC50: 620nMAssay Description:Inhibition of human SPPL2a expressed in HEK293 cells cotransfected with Gal4 luciferase reporter plasmid and VP16-TNFalpha(1-76)-NTF incubated for 24...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546129(CHEMBL4785324)
Show SMILES N[C@H]([C@@H](O)CN(C1CCC1)S(=O)(=O)c1ccc2scnc2c1)c1ccccc1
Show InChI InChI=1S/C20H23N3O3S2/c21-20(14-5-2-1-3-6-14)18(24)12-23(15-7-4-8-15)28(25,26)16-9-10-19-17(11-16)22-13-27-19/h1-3,5-6,9-11,13,15,18,20,24H,4,7-8,12,21H2/t18-,20-/m0/s1
Affinity DataIC50: 840nMAssay Description:Inhibition of human SPPL2a expressed in HEK293 cells cotransfected with Gal4 luciferase reporter plasmid and VP16-TNFalpha(1-76)-NTF incubated for 24...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546120(CHEMBL4743609)
Show SMILES CC(C)CN(C[C@H](O)[C@@H](N)Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C20H26Cl2N2O3S/c1-14(2)12-24(28(26,27)16-8-9-17(21)18(22)11-16)13-20(25)19(23)10-15-6-4-3-5-7-15/h3-9,11,14,19-20,25H,10,12-13,23H2,1-2H3/t19-,20-/m0/s1
Affinity DataIC50: 860nMAssay Description:Inhibition of human SPPL2a expressed in HEK293 cells cotransfected with Gal4 luciferase reporter plasmid and VP16-TNFalpha(1-76)-NTF incubated for 24...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546127(CHEMBL4753079)
Show SMILES CC1(CCC1)N(C[C@H](O)[C@@H](N)c1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C20H24Cl2N2O3S/c1-20(10-5-11-20)24(13-18(25)19(23)14-6-3-2-4-7-14)28(26,27)15-8-9-16(21)17(22)12-15/h2-4,6-9,12,18-19,25H,5,10-11,13,23H2,1H3/t18-,19-/m0/s1
Affinity DataIC50: 900nMAssay Description:Inhibition of human SPPL2a expressed in HEK293 cells cotransfected with Gal4 luciferase reporter plasmid and VP16-TNFalpha(1-76)-NTF incubated for 24...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546121(CHEMBL4798232)
Show SMILES CC(C)(O)CN(C[C@H](O)[C@@H](N)c1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H24Cl2N2O4S/c1-19(2,25)12-23(11-17(24)18(22)13-6-4-3-5-7-13)28(26,27)14-8-9-15(20)16(21)10-14/h3-10,17-18,24-25H,11-12,22H2,1-2H3/t17-,18-/m0/s1
Affinity DataIC50: 910nMAssay Description:Inhibition of human SPPL2a expressed in HEK293 cells cotransfected with Gal4 luciferase reporter plasmid and VP16-TNFalpha(1-76)-NTF incubated for 24...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetPresenilin-1(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546132(CHEMBL4759048)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)N(C[C@H](O)[C@@H](N)c1ccc(OC(F)(F)F)cc1)C1CCC1
Show InChI InChI=1S/C24H31F3N2O4S/c1-23(2,3)17-9-13-20(14-10-17)34(31,32)29(18-5-4-6-18)15-21(30)22(28)16-7-11-19(12-8-16)33-24(25,26)27/h7-14,18,21-22,30H,4-6,15,28H2,1-3H3/t21-,22-/m0/s1
Affinity DataIC50: 1.30E+3nMAssay Description:Inhibition of gamma-secretase (unknown origin) expressed in HEK293 cells cotransfected with Notch1-VP16-GAL4 fusion and Gal4 luciferase reporter plas...More data for this Ligand-Target Pair
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546126(CHEMBL4741014)
Show SMILES N[C@H]([C@@H](O)CN(C1COC1)S(=O)(=O)c1ccc(Cl)c(Cl)c1)c1ccccc1
Show InChI InChI=1S/C18H20Cl2N2O4S/c19-15-7-6-14(8-16(15)20)27(24,25)22(13-10-26-11-13)9-17(23)18(21)12-4-2-1-3-5-12/h1-8,13,17-18,23H,9-11,21H2/t17-,18-/m0/s1
Affinity DataIC50: 1.50E+3nMAssay Description:Inhibition of human SPPL2a expressed in HEK293 cells cotransfected with Gal4 luciferase reporter plasmid and VP16-TNFalpha(1-76)-NTF incubated for 24...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetPresenilin-1(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546128(CHEMBL4753654)
Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)S(=O)(=O)N(C[C@H](O)[C@@H](N)c1ccccc1)C1CCC1
Show InChI InChI=1S/C27H38N2O3S/c1-26(2)15-16-27(3,4)23-17-21(13-14-22(23)26)33(31,32)29(20-11-8-12-20)18-24(30)25(28)19-9-6-5-7-10-19/h5-7,9-10,13-14,17,20,24-25,30H,8,11-12,15-16,18,28H2,1-4H3/t24-,25-/m0/s1
Affinity DataIC50: 1.80E+3nMAssay Description:Inhibition of gamma-secretase (unknown origin) expressed in HEK293 cells cotransfected with Notch1-VP16-GAL4 fusion and Gal4 luciferase reporter plas...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetPresenilin-1(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546125(CHEMBL4792187)
Show SMILES N[C@H]([C@@H](O)CN(C1CCCCCC1)S(=O)(=O)c1ccc(Cl)c(Cl)c1)c1ccccc1
Show InChI InChI=1S/C22H28Cl2N2O3S/c23-19-13-12-18(14-20(19)24)30(28,29)26(17-10-6-1-2-7-11-17)15-21(27)22(25)16-8-4-3-5-9-16/h3-5,8-9,12-14,17,21-22,27H,1-2,6-7,10-11,15,25H2/t21-,22-/m0/s1
Affinity DataIC50: 2.10E+3nMAssay Description:Inhibition of gamma-secretase (unknown origin) expressed in HEK293 cells cotransfected with Notch1-VP16-GAL4 fusion and Gal4 luciferase reporter plas...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetPresenilin-1(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546123(CHEMBL4789381)
Show SMILES N[C@H]([C@@H](O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1)c1ccccc1
Show InChI InChI=1S/C22H22Cl2N2O3S/c23-19-12-11-18(13-20(19)24)30(28,29)26(14-16-7-3-1-4-8-16)15-21(27)22(25)17-9-5-2-6-10-17/h1-13,21-22,27H,14-15,25H2/t21-,22-/m0/s1
Affinity DataIC50: 3.40E+3nMAssay Description:Inhibition of gamma-secretase (unknown origin) expressed in HEK293 cells cotransfected with Notch1-VP16-GAL4 fusion and Gal4 luciferase reporter plas...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetPresenilin-1(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546130(CHEMBL4762492)
Show SMILES CC(C)(C)c1cccc(c1)S(=O)(=O)N(C[C@H](O)[C@@H](N)c1ccccc1)C1CCC1
Show InChI InChI=1S/C23H32N2O3S/c1-23(2,3)18-11-7-14-20(15-18)29(27,28)25(19-12-8-13-19)16-21(26)22(24)17-9-5-4-6-10-17/h4-7,9-11,14-15,19,21-22,26H,8,12-13,16,24H2,1-3H3/t21-,22-/m0/s1
Affinity DataIC50: 3.70E+3nMAssay Description:Inhibition of gamma-secretase (unknown origin) expressed in HEK293 cells cotransfected with Notch1-VP16-GAL4 fusion and Gal4 luciferase reporter plas...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetPresenilin-1(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546131(CHEMBL4759943)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)N(C[C@H](O)[C@@H](N)c1ccccc1)C1CCC1
Show InChI InChI=1S/C23H32N2O3S/c1-23(2,3)18-12-14-20(15-13-18)29(27,28)25(19-10-7-11-19)16-21(26)22(24)17-8-5-4-6-9-17/h4-6,8-9,12-15,19,21-22,26H,7,10-11,16,24H2,1-3H3/t21-,22-/m0/s1
Affinity DataIC50: 3.70E+3nMAssay Description:Inhibition of gamma-secretase (unknown origin) expressed in HEK293 cells cotransfected with Notch1-VP16-GAL4 fusion and Gal4 luciferase reporter plas...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetSignal peptide peptidase-like 2A(Homo sapiens)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546119(CHEMBL4762488)
Show SMILES CC(C)CN(C[C@H](O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C28H32Cl2N2O5S/c1-20(2)17-32(38(35,36)23-13-14-24(29)25(30)16-23)18-27(33)26(15-21-9-5-3-6-10-21)31-28(34)37-19-22-11-7-4-8-12-22/h3-14,16,20,26-27,33H,15,17-19H2,1-2H3,(H,31,34)/t26-,27-/m0/s1
Affinity DataIC50: 4.30E+3nMAssay Description:Inhibition of human SPPL2a expressed in HEK293 cells cotransfected with Gal4 luciferase reporter plasmid and VP16-TNFalpha(1-76)-NTF incubated for 24...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
LigandPNGBDBM50546118(CHEMBL4762370)
Show SMILES CC(C)CN(C[C@H](O)[C@@H](N)c1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H24Cl2N2O3S/c1-13(2)11-23(12-18(24)19(22)14-6-4-3-5-7-14)27(25,26)15-8-9-16(20)17(21)10-15/h3-10,13,18-19,24H,11-12,22H2,1-2H3/t18-,19-/m0/s1
Affinity DataIC50: 4.80E+3nMAssay Description:Inhibition of gamma-secretase (unknown origin) expressed in HEK293 cells cotransfected with Notch1-VP16-GAL4 fusion and Gal4 luciferase reporter plas...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetPresenilin-1(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546124(CHEMBL4740837)
Show SMILES N[C@H]([C@@H](O)CN(C1CCC1)S(=O)(=O)c1ccc(Cl)c(Cl)c1)c1ccccc1
Show InChI InChI=1S/C19H22Cl2N2O3S/c20-16-10-9-15(11-17(16)21)27(25,26)23(14-7-4-8-14)12-18(24)19(22)13-5-2-1-3-6-13/h1-3,5-6,9-11,14,18-19,24H,4,7-8,12,22H2/t18-,19-/m0/s1
Affinity DataIC50: 5.10E+3nMAssay Description:Inhibition of gamma-secretase (unknown origin) expressed in HEK293 cells cotransfected with Notch1-VP16-GAL4 fusion and Gal4 luciferase reporter plas...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetPresenilin-1(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546122(CHEMBL4747630)
Show SMILES CC(C)ON(C[C@H](O)[C@@H](N)c1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C18H22Cl2N2O4S/c1-12(2)26-22(11-17(23)18(21)13-6-4-3-5-7-13)27(24,25)14-8-9-15(19)16(20)10-14/h3-10,12,17-18,23H,11,21H2,1-2H3/t17-,18-/m0/s1
Affinity DataIC50: 5.90E+3nMAssay Description:Inhibition of gamma-secretase (unknown origin) expressed in HEK293 cells cotransfected with Notch1-VP16-GAL4 fusion and Gal4 luciferase reporter plas...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetPresenilin-1(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546127(CHEMBL4753079)
Show SMILES CC1(CCC1)N(C[C@H](O)[C@@H](N)c1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C20H24Cl2N2O3S/c1-20(10-5-11-20)24(13-18(25)19(23)14-6-3-2-4-7-14)28(26,27)15-8-9-16(21)17(22)12-15/h2-4,6-9,12,18-19,25H,5,10-11,13,23H2,1H3/t18-,19-/m0/s1
Affinity DataIC50: 6.40E+3nMAssay Description:Inhibition of gamma-secretase (unknown origin) expressed in HEK293 cells cotransfected with Notch1-VP16-GAL4 fusion and Gal4 luciferase reporter plas...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetPresenilin-1(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546121(CHEMBL4798232)
Show SMILES CC(C)(O)CN(C[C@H](O)[C@@H](N)c1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H24Cl2N2O4S/c1-19(2,25)12-23(11-17(24)18(22)13-6-4-3-5-7-13)28(26,27)14-8-9-15(20)16(21)10-14/h3-10,17-18,24-25H,11-12,22H2,1-2H3/t17-,18-/m0/s1
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of gamma-secretase (unknown origin) expressed in HEK293 cells cotransfected with Notch1-VP16-GAL4 fusion and Gal4 luciferase reporter plas...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetPresenilin-1(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546126(CHEMBL4741014)
Show SMILES N[C@H]([C@@H](O)CN(C1COC1)S(=O)(=O)c1ccc(Cl)c(Cl)c1)c1ccccc1
Show InChI InChI=1S/C18H20Cl2N2O4S/c19-15-7-6-14(8-16(15)20)27(24,25)22(13-10-26-11-13)9-17(23)18(21)12-4-2-1-3-5-12/h1-8,13,17-18,23H,9-11,21H2/t17-,18-/m0/s1
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of gamma-secretase (unknown origin) expressed in HEK293 cells cotransfected with Notch1-VP16-GAL4 fusion and Gal4 luciferase reporter plas...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetPresenilin-1(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546129(CHEMBL4785324)
Show SMILES N[C@H]([C@@H](O)CN(C1CCC1)S(=O)(=O)c1ccc2scnc2c1)c1ccccc1
Show InChI InChI=1S/C20H23N3O3S2/c21-20(14-5-2-1-3-6-14)18(24)12-23(15-7-4-8-15)28(25,26)16-9-10-19-17(11-16)22-13-27-19/h1-3,5-6,9-11,13,15,18,20,24H,4,7-8,12,21H2/t18-,20-/m0/s1
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of gamma-secretase (unknown origin) expressed in HEK293 cells cotransfected with Notch1-VP16-GAL4 fusion and Gal4 luciferase reporter plas...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBeta-secretase 1(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546118(CHEMBL4762370)
Show SMILES CC(C)CN(C[C@H](O)[C@@H](N)c1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H24Cl2N2O3S/c1-13(2)11-23(12-18(24)19(22)14-6-4-3-5-7-14)27(25,26)15-8-9-16(20)17(21)10-15/h3-10,13,18-19,24H,11-12,22H2,1-2H3/t18-,19-/m0/s1
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of human BACE1 (46 to 435 residues) expressed in baculovirus infected insect cells using Ac-C(PT14)EVNLDAEWK-NH2 as substrate preincubated...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBeta-secretase 2(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546118(CHEMBL4762370)
Show SMILES CC(C)CN(C[C@H](O)[C@@H](N)c1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H24Cl2N2O3S/c1-13(2)11-23(12-18(24)19(22)14-6-4-3-5-7-14)27(25,26)15-8-9-16(20)17(21)10-15/h3-10,13,18-19,24H,11-12,22H2,1-2H3/t18-,19-/m0/s1
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of human BACE2 (63 to 466 residues) expressed in baculovirus infected insect cells using Ac-C(PT14)EVNLDAEWK-NH2 as substrate preincubated...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetRenin(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546118(CHEMBL4762370)
Show SMILES CC(C)CN(C[C@H](O)[C@@H](N)c1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H24Cl2N2O3S/c1-13(2)11-23(12-18(24)19(22)14-6-4-3-5-7-14)27(25,26)15-8-9-16(20)17(21)10-15/h3-10,13,18-19,24H,11-12,22H2,1-2H3/t18-,19-/m0/s1
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of human renin (67 to 406 residues) expressed in CHO cells using KHPWHLVIHT-C(PT14)-K as substrate preincubated for 1 hr followed by subst...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetCathepsin E(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546118(CHEMBL4762370)
Show SMILES CC(C)CN(C[C@H](O)[C@@H](N)c1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H24Cl2N2O3S/c1-13(2)11-23(12-18(24)19(22)14-6-4-3-5-7-14)27(25,26)15-8-9-16(20)17(21)10-15/h3-10,13,18-19,24H,11-12,22H2,1-2H3/t18-,19-/m0/s1
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of human cathepsin E isoform 1 (19 to 401 residues) expressed in Escherichia coli using R-C(PT14)KPILFFRLGWR-OH as substrate preincubated ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetCathepsin D(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50546118(CHEMBL4762370)
Show SMILES CC(C)CN(C[C@H](O)[C@@H](N)c1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H24Cl2N2O3S/c1-13(2)11-23(12-18(24)19(22)14-6-4-3-5-7-14)27(25,26)15-8-9-16(20)17(21)10-15/h3-10,13,18-19,24H,11-12,22H2,1-2H3/t18-,19-/m0/s1
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of human cathepsin D (1 to 412 residues) expressed in baculovirus infected insect cells using R-C(PT14)-KPILFFRLGWR-OH as substrate preinc...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid