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BDBM260159 BDBM50177661::US9504692, Mepezine

SMILES: CN1CCCC(CN2c3ccccc3Sc3ccccc23)C1

InChI Key: InChIKey=CBHCDHNUZWWAPP-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 260159   
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
GST-MALT lymphoma-associated translocation (MALT1)


(Homo sapiens (Human))
BDBM260159
PNG
(BDBM50177661 | US9504692, Mepezine)
Show SMILES CN1CCCC(CN2c3ccccc3Sc3ccccc23)C1
Show InChI InChI=1S/C19H22N2S/c1-20-12-6-7-15(13-20)14-21-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)21/h2-5,8-11,15H,6-7,12-14H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 850n/an/an/an/an/a30



HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH)

US Patent


Assay Description
To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...


US Patent US9504692 (2016)


BindingDB Entry DOI: 10.7270/Q21C1VSR
More data for this
Ligand-Target Pair
MALT lymphoma-associated translocation (MALT1)


(Homo sapiens (Human))
BDBM260159
PNG
(BDBM50177661 | US9504692, Mepezine)
Show SMILES CN1CCCC(CN2c3ccccc3Sc3ccccc23)C1
Show InChI InChI=1S/C19H22N2S/c1-20-12-6-7-15(13-20)14-21-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)21/h2-5,8-11,15H,6-7,12-14H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 830n/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Inhibition of recombinant full length GST-MALT1 (unknown origin) expressed in Escherichia coli using Ac-LRSR-AMC as substrate by fluorescence analysi...


Bioorg Med Chem 24: 3312-29 (2016)


Article DOI: 10.1016/j.bmc.2016.03.035
BindingDB Entry DOI: 10.7270/Q21G0P58
More data for this
Ligand-Target Pair
MALT lymphoma-associated translocation (MALT1)


(Homo sapiens (Human))
BDBM260159
PNG
(BDBM50177661 | US9504692, Mepezine)
Show SMILES CN1CCCC(CN2c3ccccc3Sc3ccccc23)C1
Show InChI InChI=1S/C19H22N2S/c1-20-12-6-7-15(13-20)14-21-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)21/h2-5,8-11,15H,6-7,12-14H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 420n/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Inhibition of GST-MALT1 (325 to 760 residues) (unknown origin) using Ac-LRSR-AMC as substrate by fluorescence analysis


Bioorg Med Chem 24: 3312-29 (2016)


Article DOI: 10.1016/j.bmc.2016.03.035
BindingDB Entry DOI: 10.7270/Q21G0P58
More data for this
Ligand-Target Pair