BindingDB logo
myBDB logout

PubMed code 19012391

Compile data set for download or QSAR
Found 8 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Gamma-Secretase


(Homo sapiens (human)-Homo sapiens (Human))
BDBM28921
PNG
((2S,3S)-N-(4-bromophenyl)-1-hydroxy-3-methylpentan...)
Show SMILES CC[C@H](C)[C@@H](CO)NS(=O)(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C12H18BrNO3S/c1-3-9(2)12(8-15)14-18(16,17)11-6-4-10(13)5-7-11/h4-7,9,12,14-15H,3,8H2,1-2H3/t9-,12+/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 2.21E+3n/an/an/an/a



Wyeth Research



Assay Description
A Chinese Hamster Ovary cell line stably expressing human beta-APP were aliquoted into a 96-well plate, and after attachment the medium was replaced ...


J Med Chem 51: 7348-51 (2008)


Article DOI: 10.1021/jm801252w
BindingDB Entry DOI: 10.7270/Q2BC3WW2
More data for this
Ligand-Target Pair
Gamma-Secretase


(Homo sapiens (human)-Homo sapiens (Human))
BDBM28923
PNG
((2S)-N-(4-chlorophenyl)-3-ethyl-1-hydroxypentane-2...)
Show SMILES CCC(CC)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C13H20ClNO3S/c1-3-10(4-2)13(9-16)15-19(17,18)12-7-5-11(14)6-8-12/h5-8,10,13,15-16H,3-4,9H2,1-2H3/t13-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 294n/an/an/an/a



Wyeth Research



Assay Description
A Chinese Hamster Ovary cell line stably expressing human beta-APP were aliquoted into a 96-well plate, and after attachment the medium was replaced ...


J Med Chem 51: 7348-51 (2008)


Article DOI: 10.1021/jm801252w
BindingDB Entry DOI: 10.7270/Q2BC3WW2
More data for this
Ligand-Target Pair
Gamma-Secretase


(Homo sapiens (human)-Homo sapiens (Human))
BDBM28926
PNG
((2S)-N-(5-chlorothiophen-2-yl)-5,5,5-trifluoro-1-h...)
Show SMILES OC[C@@H](NS(=O)(=O)c1ccc(Cl)s1)C(CC(F)(F)F)CC(F)(F)F
Show InChI InChI=1S/C11H12ClF6NO3S2/c12-8-1-2-9(23-8)24(21,22)19-7(5-20)6(3-10(13,14)15)4-11(16,17)18/h1-2,6-7,19-20H,3-5H2/t7-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 16n/an/an/an/a



Wyeth Research



Assay Description
A Chinese Hamster Ovary cell line stably expressing human beta-APP were aliquoted into a 96-well plate, and after attachment the medium was replaced ...


J Med Chem 51: 7348-51 (2008)


Article DOI: 10.1021/jm801252w
BindingDB Entry DOI: 10.7270/Q2BC3WW2
More data for this
Ligand-Target Pair
Gamma-Secretase


(Homo sapiens (human)-Homo sapiens (Human))
BDBM28927
PNG
((2R)-N-(5-chlorothiophen-2-yl)-4,4,4-trifluoro-1-h...)
Show SMILES OC[C@H](NS(=O)(=O)c1ccc(Cl)s1)C(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C9H8ClF6NO3S2/c10-5-1-2-6(21-5)22(19,20)17-4(3-18)7(8(11,12)13)9(14,15)16/h1-2,4,7,17-18H,3H2/t4-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.07E+4n/an/an/an/a



Wyeth Research



Assay Description
A Chinese Hamster Ovary cell line stably expressing human beta-APP were aliquoted into a 96-well plate, and after attachment the medium was replaced ...


J Med Chem 51: 7348-51 (2008)


Article DOI: 10.1021/jm801252w
BindingDB Entry DOI: 10.7270/Q2BC3WW2
More data for this
Ligand-Target Pair
Gamma-Secretase


(Homo sapiens (human)-Homo sapiens (Human))
BDBM28922
PNG
((2S)-N-(5-chlorothiophen-2-yl)-4,4,4-trifluoro-1-h...)
Show SMILES OC[C@@H](NS(=O)(=O)c1ccc(Cl)s1)C(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C9H8ClF6NO3S2/c10-5-1-2-6(21-5)22(19,20)17-4(3-18)7(8(11,12)13)9(14,15)16/h1-2,4,7,17-18H,3H2/t4-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 15n/an/an/an/a



Wyeth Research



Assay Description
A Chinese Hamster Ovary cell line stably expressing human beta-APP were aliquoted into a 96-well plate, and after attachment the medium was replaced ...


J Med Chem 51: 7348-51 (2008)


Article DOI: 10.1021/jm801252w
BindingDB Entry DOI: 10.7270/Q2BC3WW2
More data for this
Ligand-Target Pair
Gamma-Secretase


(Homo sapiens (human)-Homo sapiens (Human))
BDBM28920
PNG
((2S,3S)-N-(4-chlorophenyl)-1-hydroxy-3-methylpenta...)
Show SMILES CC[C@H](C)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C12H18ClNO3S/c1-3-9(2)12(8-15)14-18(16,17)11-6-4-10(13)5-7-11/h4-7,9,12,14-15H,3,8H2,1-2H3/t9-,12+/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 5.45E+3n/an/an/an/a



Wyeth Research



Assay Description
A Chinese Hamster Ovary cell line stably expressing human beta-APP were aliquoted into a 96-well plate, and after attachment the medium was replaced ...


J Med Chem 51: 7348-51 (2008)


Article DOI: 10.1021/jm801252w
BindingDB Entry DOI: 10.7270/Q2BC3WW2
More data for this
Ligand-Target Pair
Gamma-Secretase


(Homo sapiens (human)-Homo sapiens (Human))
BDBM28925
PNG
((2S)-N-(5-chlorothiophen-2-yl)-3-ethyl-1-hydroxype...)
Show SMILES CCC(CC)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)s1
Show InChI InChI=1S/C11H18ClNO3S2/c1-3-8(4-2)9(7-14)13-18(15,16)11-6-5-10(12)17-11/h5-6,8-9,13-14H,3-4,7H2,1-2H3/t9-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 25n/an/an/an/a



Wyeth Research



Assay Description
A Chinese Hamster Ovary cell line stably expressing human beta-APP were aliquoted into a 96-well plate, and after attachment the medium was replaced ...


J Med Chem 51: 7348-51 (2008)


Article DOI: 10.1021/jm801252w
BindingDB Entry DOI: 10.7270/Q2BC3WW2
More data for this
Ligand-Target Pair
Gamma-Secretase


(Homo sapiens (human)-Homo sapiens (Human))
BDBM28924
PNG
((2S,3S)-N-(5-chlorothiophen-2-yl)-1-hydroxy-3-meth...)
Show SMILES CC[C@H](C)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)s1
Show InChI InChI=1S/C10H16ClNO3S2/c1-3-7(2)8(6-13)12-17(14,15)10-5-4-9(11)16-10/h4-5,7-8,12-13H,3,6H2,1-2H3/t7-,8+/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 297n/an/an/an/a



Wyeth Research



Assay Description
A Chinese Hamster Ovary cell line stably expressing human beta-APP were aliquoted into a 96-well plate, and after attachment the medium was replaced ...


J Med Chem 51: 7348-51 (2008)


Article DOI: 10.1021/jm801252w
BindingDB Entry DOI: 10.7270/Q2BC3WW2
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%