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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Receptor-interacting serine/threonine-protein kinase 2' and Ligand = 'BDBM50279316'   
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
Receptor-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50279316
PNG
(CHEMBL4167668)
Show SMILES COc1cc2ncc(-c3ccc4[nH]ncc4c3)n2cc1S(=O)(=O)C(C)(C)C
Show InChI InChI=1S/C19H20N4O3S/c1-19(2,3)27(24,25)17-11-23-15(10-20-18(23)8-16(17)26-4)12-5-6-14-13(7-12)9-21-22-14/h5-11H,1-4H3,(H,21,22)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Inhibition of full length RIPK2 (unknown origin) pretreated for 30 mins followed by ATP addition measured after 2 hrs by ADP-d2 tracer based fluoresc...


ACS Med Chem Lett 8: 1048-1053 (2017)


Article DOI: 10.1021/acsmedchemlett.7b00258
BindingDB Entry DOI: 10.7270/Q2ST7SBP
More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50279316
PNG
(CHEMBL4167668)
Show SMILES COc1cc2ncc(-c3ccc4[nH]ncc4c3)n2cc1S(=O)(=O)C(C)(C)C
Show InChI InChI=1S/C19H20N4O3S/c1-19(2,3)27(24,25)17-11-23-15(10-20-18(23)8-16(17)26-4)12-5-6-14-13(7-12)9-21-22-14/h5-11H,1-4H3,(H,21,22)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 130n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Inhibition of RIPK2 in human PBMCs assessed as reduction in MDP-stimulated IL8 secretion measured after 18 hrs


ACS Med Chem Lett 8: 1048-1053 (2017)


Article DOI: 10.1021/acsmedchemlett.7b00258
BindingDB Entry DOI: 10.7270/Q2ST7SBP
More data for this
Ligand-Target Pair