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SMILES: NC(=N)N\N=C\c1c(nc2sccn12)-c1cc(Cl)sc1Cl

InChI Key: InChIKey=KYILJEHHCLLGAI-AYSLTRBKSA-N

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50355603   
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
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM50355603
PNG
(CHEMBL1910757)
Show SMILES NC(=N)N\N=C\c1c(nc2sccn12)-c1cc(Cl)sc1Cl
Show InChI InChI=1S/C11H8Cl2N6S2/c12-7-3-5(9(13)21-7)8-6(4-16-18-10(14)15)19-1-2-20-11(19)17-8/h1-4H,(H4,14,15,18)/b16-4+
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Universit£ di Bologna

Curated by ChEMBL


Assay Description
Inhibition of CHK1 assessed as inhibition of substrate phosphorylation using fluorescent peptide substrate by microplate reader assay


Eur J Med Chem 46: 4311-23 (2011)


Article DOI: 10.1016/j.ejmech.2011.07.001
BindingDB Entry DOI: 10.7270/Q2NG4R1D
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk2


(Homo sapiens (Human))
BDBM50355603
PNG
(CHEMBL1910757)
Show SMILES NC(=N)N\N=C\c1c(nc2sccn12)-c1cc(Cl)sc1Cl
Show InChI InChI=1S/C11H8Cl2N6S2/c12-7-3-5(9(13)21-7)8-6(4-16-18-10(14)15)19-1-2-20-11(19)17-8/h1-4H,(H4,14,15,18)/b16-4+
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 6.50E+4n/an/an/an/an/an/a



Universit£ di Bologna

Curated by ChEMBL


Assay Description
Inhibition of CHK2 assessed as inhibition of substrate phosphorylation using fluorescent peptide substrate by microplate reader assay


Eur J Med Chem 46: 4311-23 (2011)


Article DOI: 10.1016/j.ejmech.2011.07.001
BindingDB Entry DOI: 10.7270/Q2NG4R1D
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM50355603
PNG
(CHEMBL1910757)
Show SMILES NC(=N)N\N=C\c1c(nc2sccn12)-c1cc(Cl)sc1Cl
Show InChI InChI=1S/C11H8Cl2N6S2/c12-7-3-5(9(13)21-7)8-6(4-16-18-10(14)15)19-1-2-20-11(19)17-8/h1-4H,(H4,14,15,18)/b16-4+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 7.90E+4n/an/an/an/an/an/a



Universit£ di Bologna

Curated by ChEMBL


Assay Description
Inhibition of RSK2 assessed as inhibition of substrate phosphorylation using fluorescent peptide substrate by microplate reader assay


Eur J Med Chem 46: 4311-23 (2011)


Article DOI: 10.1016/j.ejmech.2011.07.001
BindingDB Entry DOI: 10.7270/Q2NG4R1D
More data for this
Ligand-Target Pair