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BDBM142654 US8937068, 30

SMILES: Oc1ccc(cc1)-c1cnc2ccc(NC(=S)NCC=C)nc2n1

InChI Key: InChIKey=YKMUCILEPVJXKD-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 = 142654   
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
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM142654
PNG
(US8937068, 30)
Show SMILES Oc1ccc(cc1)-c1cnc2ccc(NC(=S)NCC=C)nc2n1
Show InChI InChI=1S/C17H15N5OS/c1-2-9-18-17(24)22-15-8-7-13-16(21-15)20-14(10-19-13)11-3-5-12(23)6-4-11/h2-8,10,23H,1,9H2,(H2,18,20,21,22,24)
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PC sid
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US Patent
n/an/a 392n/an/an/an/an/an/a



Zentaris GmbH

US Patent


Assay Description
The inhibitory effect of the compounds according to the invention was tested on various serine/threonine, tyrosine and lipid kinases in enzymatic ass...


US Patent US8937068 (2015)


BindingDB Entry DOI: 10.7270/Q2H993WP
More data for this
Ligand-Target Pair
Jnk1 & Jnk2


(Homo sapiens (Human))
BDBM142654
PNG
(US8937068, 30)
Show SMILES Oc1ccc(cc1)-c1cnc2ccc(NC(=S)NCC=C)nc2n1
Show InChI InChI=1S/C17H15N5OS/c1-2-9-18-17(24)22-15-8-7-13-16(21-15)20-14(10-19-13)11-3-5-12(23)6-4-11/h2-8,10,23H,1,9H2,(H2,18,20,21,22,24)
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

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US Patent
n/an/a 2.18E+4n/an/an/an/an/an/a



Zentaris GmbH

US Patent


Assay Description
The inhibitory effect of the compounds according to the invention was tested on various serine/threonine, tyrosine and lipid kinases in enzymatic ass...


US Patent US8937068 (2015)


BindingDB Entry DOI: 10.7270/Q2H993WP
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM142654
PNG
(US8937068, 30)
Show SMILES Oc1ccc(cc1)-c1cnc2ccc(NC(=S)NCC=C)nc2n1
Show InChI InChI=1S/C17H15N5OS/c1-2-9-18-17(24)22-15-8-7-13-16(21-15)20-14(10-19-13)11-3-5-12(23)6-4-11/h2-8,10,23H,1,9H2,(H2,18,20,21,22,24)
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UniChem

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US Patent
n/an/a>1.00E+5n/an/an/an/an/an/a



Zentaris GmbH

US Patent


Assay Description
The inhibitory effect of the compounds according to the invention was tested on various serine/threonine, tyrosine and lipid kinases in enzymatic ass...


US Patent US8937068 (2015)


BindingDB Entry DOI: 10.7270/Q2H993WP
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM142654
PNG
(US8937068, 30)
Show SMILES Oc1ccc(cc1)-c1cnc2ccc(NC(=S)NCC=C)nc2n1
Show InChI InChI=1S/C17H15N5OS/c1-2-9-18-17(24)22-15-8-7-13-16(21-15)20-14(10-19-13)11-3-5-12(23)6-4-11/h2-8,10,23H,1,9H2,(H2,18,20,21,22,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 370n/an/an/an/an/an/a



Zentaris GmbH

US Patent


Assay Description
The inhibitory effect of the compounds according to the invention was tested on various serine/threonine, tyrosine and lipid kinases in enzymatic ass...


US Patent US8937068 (2015)


BindingDB Entry DOI: 10.7270/Q2H993WP
More data for this
Ligand-Target Pair