Found 12 hits of Enzyme Inhibition Constant Data 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 |
|---|
Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2
(Homo sapiens (Human)) | BDBM50121365
(CHEMBL3622125)Show SMILES COc1cc(ccn1)N1CCC(CC1)Nc1ncc2OCCN(c3ccc(F)cc3C(F)(F)F)c2n1 Show InChI InChI=1S/C24H24F4N6O2/c1-35-21-13-17(4-7-29-21)33-8-5-16(6-9-33)31-23-30-14-20-22(32-23)34(10-11-36-20)19-3-2-15(25)12-18(19)24(26,27)28/h2-4,7,12-14,16H,5-6,8-11H2,1H3,(H,30,31,32) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
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antibodypedia
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GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Temple University School of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of gamma-secretase in human H4 cells expressing human wild type APP75I cDNA assessed as reduction in amyloid beta peptides incubated for 1... |
ACS Med Chem Lett 6: 836-7 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00259
BindingDB Entry DOI: 10.7270/Q2ZG6V16 |
More data for this
Ligand-Target Pair | |
Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2
(Homo sapiens (Human)) | BDBM50121370
(CHEMBL3622121)Show SMILES COc1cc(ccn1)N1CCC(CC1)Nc1ncc2OCCN(c3ccccc3OC(F)(F)F)c2n1 Show InChI InChI=1S/C24H25F3N6O3/c1-34-21-14-17(6-9-28-21)32-10-7-16(8-11-32)30-23-29-15-20-22(31-23)33(12-13-35-20)18-4-2-3-5-19(18)36-24(25,26)27/h2-6,9,14-16H,7-8,10-13H2,1H3,(H,29,30,31) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
Temple University School of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of gamma-secretase in human H4 cells expressing human wild type APP75I cDNA assessed as reduction in amyloid beta peptides incubated for 1... |
ACS Med Chem Lett 6: 836-7 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00259
BindingDB Entry DOI: 10.7270/Q2ZG6V16 |
More data for this
Ligand-Target Pair | |
Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2
(Homo sapiens (Human)) | BDBM50121374
(CHEMBL3622117)Show SMILES COc1cc(ccn1)N1CCC(CC1)Nc1ncc2OCCN(c3ccccc3)c2n1 Show InChI InChI=1S/C23H26N6O2/c1-30-21-15-19(7-10-24-21)28-11-8-17(9-12-28)26-23-25-16-20-22(27-23)29(13-14-31-20)18-5-3-2-4-6-18/h2-7,10,15-17H,8-9,11-14H2,1H3,(H,25,26,27) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Temple University School of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of gamma-secretase in human H4 cells expressing human wild type APP75I cDNA assessed as reduction in amyloid beta peptides incubated for 1... |
ACS Med Chem Lett 6: 836-7 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00259
BindingDB Entry DOI: 10.7270/Q2ZG6V16 |
More data for this
Ligand-Target Pair | |
Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2
(Homo sapiens (Human)) | BDBM50121366
(CHEMBL3622124)Show SMILES COc1cc(ccn1)N1CCC(CC1)Nc1ncc2OCCN(c3ccc(Cl)cc3)c2n1 Show InChI InChI=1S/C23H25ClN6O2/c1-31-21-14-19(6-9-25-21)29-10-7-17(8-11-29)27-23-26-15-20-22(28-23)30(12-13-32-20)18-4-2-16(24)3-5-18/h2-6,9,14-15,17H,7-8,10-13H2,1H3,(H,26,27,28) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Temple University School of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of gamma-secretase in human H4 cells expressing human wild type APP75I cDNA assessed as reduction in amyloid beta peptides incubated for 1... |
ACS Med Chem Lett 6: 836-7 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00259
BindingDB Entry DOI: 10.7270/Q2ZG6V16 |
More data for this
Ligand-Target Pair | |
Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2
(Homo sapiens (Human)) | BDBM50121375
(CHEMBL3622116)Show SMILES COc1cc(ccn1)N1CCC(CC1)Nc1ncc2OCCN(c3cc(F)cc(F)c3)c2n1 Show InChI InChI=1S/C23H24F2N6O2/c1-32-21-13-18(2-5-26-21)30-6-3-17(4-7-30)28-23-27-14-20-22(29-23)31(8-9-33-20)19-11-15(24)10-16(25)12-19/h2,5,10-14,17H,3-4,6-9H2,1H3,(H,27,28,29) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 26 | n/a | n/a | n/a | n/a | n/a | n/a |
Temple University School of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of gamma-secretase in human H4 cells expressing human wild type APP75I cDNA assessed as reduction in amyloid beta peptides incubated for 1... |
ACS Med Chem Lett 6: 836-7 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00259
BindingDB Entry DOI: 10.7270/Q2ZG6V16 |
More data for this
Ligand-Target Pair | |
Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2
(Homo sapiens (Human)) | BDBM50121364
(CHEMBL3622126)Show SMILES COc1cc(ccn1)N1CCC(CC1)Nc1ncc2OCCN(c3ccc(F)cc3)c2n1 Show InChI InChI=1S/C23H25FN6O2/c1-31-21-14-19(6-9-25-21)29-10-7-17(8-11-29)27-23-26-15-20-22(28-23)30(12-13-32-20)18-4-2-16(24)3-5-18/h2-6,9,14-15,17H,7-8,10-13H2,1H3,(H,26,27,28) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
Temple University School of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of gamma-secretase in human H4 cells expressing human wild type APP75I cDNA assessed as reduction in amyloid beta peptides incubated for 1... |
ACS Med Chem Lett 6: 836-7 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00259
BindingDB Entry DOI: 10.7270/Q2ZG6V16 |
More data for this
Ligand-Target Pair | |
Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2
(Homo sapiens (Human)) | BDBM50121373
(CHEMBL3622118)Show SMILES Clc1cc(ccn1)N1CCC(CC1)Nc1ncc2OCCN(c3ccccc3)c2n1 Show InChI InChI=1S/C22H23ClN6O/c23-20-14-18(6-9-24-20)28-10-7-16(8-11-28)26-22-25-15-19-21(27-22)29(12-13-30-19)17-4-2-1-3-5-17/h1-6,9,14-16H,7-8,10-13H2,(H,25,26,27) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 54 | n/a | n/a | n/a | n/a | n/a | n/a |
Temple University School of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of gamma-secretase in human H4 cells expressing human wild type APP75I cDNA assessed as reduction in amyloid beta peptides incubated for 1... |
ACS Med Chem Lett 6: 836-7 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00259
BindingDB Entry DOI: 10.7270/Q2ZG6V16 |
More data for this
Ligand-Target Pair | |
Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2
(Homo sapiens (Human)) | BDBM50121371
(CHEMBL3622120)Show SMILES COc1cc(ccn1)N1CCC(CC1)Nc1ncc2OCCN(c3ccccc3Cl)c2n1 Show InChI InChI=1S/C23H25ClN6O2/c1-31-21-14-17(6-9-25-21)29-10-7-16(8-11-29)27-23-26-15-20-22(28-23)30(12-13-32-20)19-5-3-2-4-18(19)24/h2-6,9,14-16H,7-8,10-13H2,1H3,(H,26,27,28) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 55 | n/a | n/a | n/a | n/a | n/a | n/a |
Temple University School of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of gamma-secretase in human H4 cells expressing human wild type APP75I cDNA assessed as reduction in amyloid beta peptides incubated for 1... |
ACS Med Chem Lett 6: 836-7 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00259
BindingDB Entry DOI: 10.7270/Q2ZG6V16 |
More data for this
Ligand-Target Pair | |
Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2
(Homo sapiens (Human)) | BDBM50121368
(CHEMBL3622122)Show SMILES COc1cc(ccn1)N1CCC(CC1)Nc1ncc2OCCN(c3cc(F)c(F)c(F)c3)c2n1 Show InChI InChI=1S/C23H23F3N6O2/c1-33-20-12-15(2-5-27-20)31-6-3-14(4-7-31)29-23-28-13-19-22(30-23)32(8-9-34-19)16-10-17(24)21(26)18(25)11-16/h2,5,10-14H,3-4,6-9H2,1H3,(H,28,29,30) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 56 | n/a | n/a | n/a | n/a | n/a | n/a |
Temple University School of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of gamma-secretase in human H4 cells expressing human wild type APP75I cDNA assessed as reduction in amyloid beta peptides incubated for 1... |
ACS Med Chem Lett 6: 836-7 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00259
BindingDB Entry DOI: 10.7270/Q2ZG6V16 |
More data for this
Ligand-Target Pair | |
Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2
(Homo sapiens (Human)) | BDBM50121372
(CHEMBL3622119)Show SMILES COc1cc(ccn1)N1CCC(CC1)Nc1ncc2OCCN(c3ccccc3C)c2n1 Show InChI InChI=1S/C24H28N6O2/c1-17-5-3-4-6-20(17)30-13-14-32-21-16-26-24(28-23(21)30)27-18-8-11-29(12-9-18)19-7-10-25-22(15-19)31-2/h3-7,10,15-16,18H,8-9,11-14H2,1-2H3,(H,26,27,28) | PDB
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UniProtKB/SwissProt
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antibodypedia
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antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 59 | n/a | n/a | n/a | n/a | n/a | n/a |
Temple University School of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of gamma-secretase in human H4 cells expressing human wild type APP75I cDNA assessed as reduction in amyloid beta peptides incubated for 1... |
ACS Med Chem Lett 6: 836-7 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00259
BindingDB Entry DOI: 10.7270/Q2ZG6V16 |
More data for this
Ligand-Target Pair | |
Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2
(Homo sapiens (Human)) | BDBM50121367
(CHEMBL3622123)Show SMILES COc1cc(ccn1)N1CCC(CC1)Nc1ncc2OCCN(c3ccc(F)cc3F)c2n1 Show InChI InChI=1S/C23H24F2N6O2/c1-32-21-13-17(4-7-26-21)30-8-5-16(6-9-30)28-23-27-14-20-22(29-23)31(10-11-33-20)19-3-2-15(24)12-18(19)25/h2-4,7,12-14,16H,5-6,8-11H2,1H3,(H,27,28,29) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
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antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 72 | n/a | n/a | n/a | n/a | n/a | n/a |
Temple University School of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of gamma-secretase in human H4 cells expressing human wild type APP75I cDNA assessed as reduction in amyloid beta peptides incubated for 1... |
ACS Med Chem Lett 6: 836-7 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00259
BindingDB Entry DOI: 10.7270/Q2ZG6V16 |
More data for this
Ligand-Target Pair | |
Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2
(Homo sapiens (Human)) | BDBM50121369
(CHEMBL3621215)Show SMILES Cc1ccccc1N1CCOc2cnc(NC3CCN(CC3)c3ccnc(Cl)c3)nc12 Show InChI InChI=1S/C23H25ClN6O/c1-16-4-2-3-5-19(16)30-12-13-31-20-15-26-23(28-22(20)30)27-17-7-10-29(11-8-17)18-6-9-25-21(24)14-18/h2-6,9,14-15,17H,7-8,10-13H2,1H3,(H,26,27,28) | PDB
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UniProtKB/SwissProt
B.MOAD
antibodypedia
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antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Temple University School of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of gamma-secretase in human H4 cells expressing human wild type APP75I cDNA assessed as reduction in amyloid beta peptides incubated for 1... |
ACS Med Chem Lett 6: 836-7 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00259
BindingDB Entry DOI: 10.7270/Q2ZG6V16 |
More data for this
Ligand-Target Pair | |
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