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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Non-receptor tyrosine-protein kinase TYK2 [V731I]' and Ligand = 'BDBM399572'   
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
Non-receptor tyrosine-protein kinase TYK2 [V731I]


(Homo sapiens (Human))		BDBM399572
PNG
(US10323036, Compound I-15 | US10793574, Compound I...)
Show SMILES COCc1ccnc(Nc2cc(Nc3cccc(-c4ncn(C)n4)c3OC)c3c(n2)[nH]n(C)c3=O)c1
Show InChI InChI=1S/C24H25N9O3/c1-32-13-26-22(30-32)15-6-5-7-16(21(15)36-4)27-17-11-19(29-23-20(17)24(34)33(2)31-23)28-18-10-14(12-35-3)8-9-25-18/h5-11,13H,12H2,1-4H3,(H3,25,27,28,29,31)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/a 0.300n/an/an/an/an/a



Novartis Institute for Tropical Diseases



Assay Description
Binding constants for compounds of the present invention against the JH2 domain were determined by the following protocol for a KINOMEscan® assay (Di...

Anal Biochem 395: 195-204 (2009)


BindingDB Entry DOI: 10.7270/Q2X63Q9X
More data for this
Ligand-Target Pair