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BDBM50075324 2-(2,6-Diethyl-phenyl)-4-hydroxy-isoindole-1,3-dione::CHEMBL153096

SMILES: CCc1cccc(CC)c1N1C(=O)c2cccc(O)c2C1=O

InChI Key: InChIKey=VAFOPKPKVXACDA-UHFFFAOYSA-N

Data: 4 IC50

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 = 50075324   
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
Aminopeptidase N


(Homo sapiens (Human))
BDBM50075324
PNG
(2-(2,6-Diethyl-phenyl)-4-hydroxy-isoindole-1,3-dio...)
Show SMILES CCc1cccc(CC)c1N1C(=O)c2cccc(O)c2C1=O
Show InChI InChI=1S/C18H17NO3/c1-3-11-7-5-8-12(4-2)16(11)19-17(21)13-9-6-10-14(20)15(13)18(19)22/h5-10,20H,3-4H2,1-2H3
PDB

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PubMed
n/an/a 3.45E+4n/an/an/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Inhibitory activity against aminopeptidase N (APN) in human acute lymphoblastic leukemia MOLT-4 cell line


Bioorg Med Chem Lett 9: 559-62 (1999)


BindingDB Entry DOI: 10.7270/Q2ZW1MFX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50075324
PNG
(2-(2,6-Diethyl-phenyl)-4-hydroxy-isoindole-1,3-dio...)
Show SMILES CCc1cccc(CC)c1N1C(=O)c2cccc(O)c2C1=O
Show InChI InChI=1S/C18H17NO3/c1-3-11-7-5-8-12(4-2)16(11)19-17(21)13-9-6-10-14(20)15(13)18(19)22/h5-10,20H,3-4H2,1-2H3
PDB
MMDB

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PubMed
n/an/a 13n/an/an/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Inhibitory activity against Dipeptidylpeptidase IV (DPP IV) in human acute lymphoblastic leukemia MOLT-4 cell line


Bioorg Med Chem Lett 9: 559-62 (1999)


BindingDB Entry DOI: 10.7270/Q2ZW1MFX
More data for this
Ligand-Target Pair
Aminopeptidase


(Homo sapiens (Human))
BDBM50075324
PNG
(2-(2,6-Diethyl-phenyl)-4-hydroxy-isoindole-1,3-dio...)
Show SMILES CCc1cccc(CC)c1N1C(=O)c2cccc(O)c2C1=O
Show InChI InChI=1S/C18H17NO3/c1-3-11-7-5-8-12(4-2)16(11)19-17(21)13-9-6-10-14(20)15(13)18(19)22/h5-10,20H,3-4H2,1-2H3
PDB

NCI pathway
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PC sid
UniChem

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PubMed
n/an/a 10n/an/an/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Inhibitory activity against aminopeptidase N (APN) in human acute lymphoblastic leukemia MOLT-4 cell line


Bioorg Med Chem Lett 9: 559-62 (1999)


BindingDB Entry DOI: 10.7270/Q2ZW1MFX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50075324
PNG
(2-(2,6-Diethyl-phenyl)-4-hydroxy-isoindole-1,3-dio...)
Show SMILES CCc1cccc(CC)c1N1C(=O)c2cccc(O)c2C1=O
Show InChI InChI=1S/C18H17NO3/c1-3-11-7-5-8-12(4-2)16(11)19-17(21)13-9-6-10-14(20)15(13)18(19)22/h5-10,20H,3-4H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 4.33E+4n/an/an/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Inhibitory activity against Dipeptidylpeptidase IV (DPP IV) in human acute lymphoblastic leukemia MOLT-4 cell line


Bioorg Med Chem Lett 9: 559-62 (1999)


BindingDB Entry DOI: 10.7270/Q2ZW1MFX
More data for this
Ligand-Target Pair