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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cytoplasmic tyrosine-protein kinase BMX' and Ligand = 'BDBM50236076'   
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
Cytoplasmic tyrosine-protein kinase BMX


(Homo sapiens (Human))
BDBM50236076
PNG
(CHEMBL4098823)
Show SMILES CC(C)C[C@H](N)C(=O)Nc1ccc(C)c(c1)N1Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc2N(C)C1=O |r|
Show InChI InChI=1S/C30H36N8O3/c1-7-26(39)35-24-13-21(10-8-18(24)4)34-29-32-15-20-16-38(30(41)37(6)27(20)36-29)25-14-22(11-9-19(25)5)33-28(40)23(31)12-17(2)3/h7-11,13-15,17,23H,1,12,16,31H2,2-6H3,(H,33,40)(H,35,39)(H,32,34,36)/t23-/m0/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 33n/an/an/an/an/an/a



High Magnetic Field Laboratory

Curated by ChEMBL


Assay Description
Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...


J Med Chem 60: 1793-1816 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01413
BindingDB Entry DOI: 10.7270/Q2GH9M74
More data for this
Ligand-Target Pair