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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 1' and Ligand = 'BDBM50263159'   
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 1


(Mus musculus)
BDBM50263159
PNG
(CHEMBL4065014)
Show SMILES Cc1cc(Nc2nc(Nc3ccc(NC(=O)C4CC4)cc3)nc(n2)N2CCOCC2)n[nH]1
Show InChI InChI=1S/C21H25N9O2/c1-13-12-17(29-28-13)24-20-25-19(26-21(27-20)30-8-10-32-11-9-30)23-16-6-4-15(5-7-16)22-18(31)14-2-3-14/h4-7,12,14H,2-3,8-11H2,1H3,(H,22,31)(H3,23,24,25,26,27,28,29)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.06E+3n/an/an/an/an/an/a



Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium.

Curated by ChEMBL


Assay Description
Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...


J Med Chem 61: 1895-1920 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01449
BindingDB Entry DOI: 10.7270/Q2930WNQ
More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1


(Mus musculus)
BDBM50263159
PNG
(CHEMBL4065014)
Show SMILES Cc1cc(Nc2nc(Nc3ccc(NC(=O)C4CC4)cc3)nc(n2)N2CCOCC2)n[nH]1
Show InChI InChI=1S/C21H25N9O2/c1-13-12-17(29-28-13)24-20-25-19(26-21(27-20)30-8-10-32-11-9-30)23-16-6-4-15(5-7-16)22-18(31)14-2-3-14/h4-7,12,14H,2-3,8-11H2,1H3,(H,22,31)(H3,23,24,25,26,27,28,29)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.64E+3n/an/an/an/an/an/a



Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium.

Curated by ChEMBL


Assay Description
Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...


J Med Chem 61: 1895-1920 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01449
BindingDB Entry DOI: 10.7270/Q2930WNQ
More data for this
Ligand-Target Pair