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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50245614   
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))
BDBM50245614
PNG
(CHEMBL4066223)
Show SMILES CN(C)C(=O)c1ccc(Nc2cc(cn(C)c2=O)-c2cccc(NC(=O)c3ccc(cc3)C(C)(C)C)c2C)cc1NC(=O)C=C
Show InChI InChI=1S/C36H39N5O4/c1-9-32(42)38-30-20-26(17-18-28(30)34(44)40(6)7)37-31-19-24(21-41(8)35(31)45)27-11-10-12-29(22(27)2)39-33(43)23-13-15-25(16-14-23)36(3,4)5/h9-21,37H,1H2,2-8H3,(H,38,42)(H,39,43)
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 34n/an/an/an/an/an/a



University of Science and Technology of China

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant human N-terminal His tagged BKT expressed in baculovirus infected Sf9 insect cells using poly (Glu,Tyr)4:1 as s...


Eur J Med Chem 131: 107-125 (2017)


Article DOI: 10.1016/j.ejmech.2017.03.001
BindingDB Entry DOI: 10.7270/Q21V5HCK
More data for this
Ligand-Target Pair