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PubMed code 24036042

Compile data set for download or QSAR
Found 2 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM50441518
PNG
(CHEMBL2436727)
Show SMILES Oc1ccc(NS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)cc1Sc1nnc[nH]1
Show InChI InChI=1S/C14H11N5O5S2/c20-12-6-1-9(7-13(12)25-14-15-8-16-17-14)18-26(23,24)11-4-2-10(3-5-11)19(21)22/h1-8,18,20H,(H,15,16,17)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.26E+3n/an/an/an/an/an/a



Shandong University

Curated by ChEMBL


Assay Description
Inhibition of AKT (unknown origin) after 30 mins by fluorescence assay


Eur J Med Chem 69: 191-200 (2013)


Article DOI: 10.1016/j.ejmech.2013.07.056
BindingDB Entry DOI: 10.7270/Q29S1SGH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM50441518
PNG
(CHEMBL2436727)
Show SMILES Oc1ccc(NS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)cc1Sc1nnc[nH]1
Show InChI InChI=1S/C14H11N5O5S2/c20-12-6-1-9(7-13(12)25-14-15-8-16-17-14)18-26(23,24)11-4-2-10(3-5-11)19(21)22/h1-8,18,20H,(H,15,16,17)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



Shandong University

Curated by ChEMBL


Assay Description
Inhibition of ABL (unknown origin) after 30 mins by fluorescence assay


Eur J Med Chem 69: 191-200 (2013)


Article DOI: 10.1016/j.ejmech.2013.07.056
BindingDB Entry DOI: 10.7270/Q29S1SGH
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%