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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase BTK' and Ligand = 'BDBM316843'   
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))
BDBM316843
PNG
(US9617260, Compound 4 | benzyl N-[3- [3-(2- oxobut...)
Show SMILES CCC(=O)C(=O)Nc1cccc(c1)-c1c[nH]c2ncc(NC(=O)OCc3ccccc3)cc12
Show InChI InChI=1S/C25H22N4O4/c1-2-22(30)24(31)28-18-10-6-9-17(11-18)21-14-27-23-20(21)12-19(13-26-23)29-25(32)33-15-16-7-4-3-5-8-16/h3-14H,2,15H2,1H3,(H,26,27)(H,28,31)(H,29,32)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 8n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
This BTK competition assay measures compound potency (IC50) for the inactivated state of Bruton's Tyrosine Kinase using FRET (Förster/Fluoresence...


US Patent US9617260 (2017)


BindingDB Entry DOI: 10.7270/Q28W3GCX
More data for this
Ligand-Target Pair