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SMILES: Cc1ccccc1SC(=N)C(C#N)C(C#N)C(=N)Sc1ccccc1C

InChI Key: InChIKey=NRMCWGBDXDBUKY-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50072161   
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
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50072161
PNG
(2,3-Bis-[1-amino-1-o-tolylsulfanyl-meth-(Z)-yliden...)
Show SMILES Cc1ccccc1SC(=N)C(C#N)C(C#N)C(=N)Sc1ccccc1C
Show InChI InChI=1S/C20H18N4S2/c1-13-7-3-5-9-17(13)25-19(23)15(11-21)16(12-22)20(24)26-18-10-6-4-8-14(18)2/h3-10,15-16,23-24H,1-2H3
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



DuPont Pharmaceuticals Company

Curated by ChEMBL


Assay Description
Non-competitive inhibition of the dual specificity kinase MEK


Bioorg Med Chem Lett 8: 2839-44 (1999)


BindingDB Entry DOI: 10.7270/Q2MW2HNN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1/2


(Homo sapiens (Human))
BDBM50072161
PNG
(2,3-Bis-[1-amino-1-o-tolylsulfanyl-meth-(Z)-yliden...)
Show SMILES Cc1ccccc1SC(=N)C(C#N)C(C#N)C(=N)Sc1ccccc1C
Show InChI InChI=1S/C20H18N4S2/c1-13-7-3-5-9-17(13)25-19(23)15(11-21)16(12-22)20(24)26-18-10-6-4-8-14(18)2/h3-10,15-16,23-24H,1-2H3
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 1.33E+4n/an/an/an/an/an/a



DuPont Pharmaceuticals Company

Curated by ChEMBL


Assay Description
Ability to antagonise AP-1 transcriptional activity


Bioorg Med Chem Lett 8: 2839-44 (1999)


BindingDB Entry DOI: 10.7270/Q2MW2HNN
More data for this
Ligand-Target Pair