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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50512817   
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
Tyrosine-protein kinase BTK


(Homo sapiens (Human))		BDBM50512817
PNG
(CHEMBL4476232)
Show SMILES CN(C)C(=S)SCCOc1ccc(Nc2ncc(F)c(Nc3cccc(NC(=O)C=C)c3)n2)cc1
Show InChI InChI=1S/C24H25FN6O2S2/c1-4-21(32)27-17-6-5-7-18(14-17)28-22-20(25)15-26-23(30-22)29-16-8-10-19(11-9-16)33-12-13-35-24(34)31(2)3/h4-11,14-15H,1,12-13H2,2-3H3,(H,27,32)(H2,26,28,29,30)
PDB
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.40n/an/an/an/an/an/a



Peking University Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant full length BTK expressed in baculovirus in Sf9 insect cells using Poly (4:1 Glu, Tyr) as substrate incubated for 1 h...

Bioorg Med Chem 27: 4124-4142 (2019)


Article DOI: 10.1016/j.bmc.2019.07.043
BindingDB Entry DOI: 10.7270/Q2DZ0CN2
More data for this
Ligand-Target Pair