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BDBM50436214 CHEMBL2398577

SMILES: CCCCCCCCCCCCCCOc1c(C)c(C)c2OC(C)(CCc2c1C)C(O)=O

InChI Key: InChIKey=OJZKZGVSDVRSAW-UHFFFAOYSA-N

Data: 3 IC50  1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50436214   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Presenilin-1


(Homo sapiens (Human))
BDBM50436214
PNG
(CHEMBL2398577)
Show SMILES CCCCCCCCCCCCCCOc1c(C)c(C)c2OC(C)(CCc2c1C)C(O)=O
Show InChI InChI=1S/C28H46O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-20-31-25-21(2)22(3)26-24(23(25)4)18-19-28(5,32-26)27(29)30/h6-20H2,1-5H3,(H,29,30)
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.16E+4n/an/an/an/an/an/a



Technische Universit£t Darmstadt

Curated by ChEMBL


Assay Description
Modulation of human gamma-secretase presenilin-1 subunit expressed in CHO cells coexpressing human APP assessed as decrease in amyloid beta 42 genera...


Bioorg Med Chem Lett 23: 3852-6 (2013)

More data for this
Ligand-Target Pair
Presenilin-1


(Homo sapiens (Human))
BDBM50436214
PNG
(CHEMBL2398577)
Show SMILES CCCCCCCCCCCCCCOc1c(C)c(C)c2OC(C)(CCc2c1C)C(O)=O
Show InChI InChI=1S/C28H46O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-20-31-25-21(2)22(3)26-24(23(25)4)18-19-28(5,32-26)27(29)30/h6-20H2,1-5H3,(H,29,30)
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 9.00E+3n/an/an/an/a



Technische Universit£t Darmstadt

Curated by ChEMBL


Assay Description
Modulation of human gamma-secretase presenilin-1 subunit expressed in CHO cells coexpressing human APP assessed as increase in amyloid beta 38 genera...


Bioorg Med Chem Lett 23: 3852-6 (2013)

More data for this
Ligand-Target Pair
Presenilin-1


(Homo sapiens (Human))
BDBM50436214
PNG
(CHEMBL2398577)
Show SMILES CCCCCCCCCCCCCCOc1c(C)c(C)c2OC(C)(CCc2c1C)C(O)=O
Show InChI InChI=1S/C28H46O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-20-31-25-21(2)22(3)26-24(23(25)4)18-19-28(5,32-26)27(29)30/h6-20H2,1-5H3,(H,29,30)
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.90E+4n/an/an/an/an/an/a



Technische Universit£t Darmstadt

Curated by ChEMBL


Assay Description
Modulation of human gamma-secretase presenilin-1 subunit expressed in CHO cells coexpressing human APP assessed as decrease in amyloid beta 40 genera...


Bioorg Med Chem Lett 23: 3852-6 (2013)

More data for this
Ligand-Target Pair
Presenilin-1


(Homo sapiens (Human))
BDBM50436214
PNG
(CHEMBL2398577)
Show SMILES CCCCCCCCCCCCCCOc1c(C)c(C)c2OC(C)(CCc2c1C)C(O)=O
Show InChI InChI=1S/C28H46O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-20-31-25-21(2)22(3)26-24(23(25)4)18-19-28(5,32-26)27(29)30/h6-20H2,1-5H3,(H,29,30)
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.40E+4n/an/an/an/an/an/a



Technische Universit£t Darmstadt

Curated by ChEMBL


Assay Description
Modulation of human gamma-secretase presenilin-1 subunit expressed in CHO cells coexpressing human APP assessed as decrease in amyloid beta 42 genera...


Bioorg Med Chem Lett 23: 3852-6 (2013)

More data for this
Ligand-Target Pair