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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase ABL2' and Ligand = 'BDBM50518790'   
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 ABL2


(Homo sapiens (Human))		BDBM50518790
PNG
(CHEMBL4465918)
Show SMILES Oc1cc2N(C[C@@H](CCl)c2c2ccccc12)C(=O)CCCC(=O)N1C[C@@H](CCl)c2c1cc(O)c1ccccc21 |r|
Show InChI InChI=1S/C31H28Cl2N2O4/c32-14-18-16-34(24-12-26(36)20-6-1-3-8-22(20)30(18)24)28(38)10-5-11-29(39)35-17-19(15-33)31-23-9-4-2-7-21(23)27(37)13-25(31)35/h1-4,6-9,12-13,18-19,36-37H,5,10-11,14-17H2/t18-,19-/m1/s1
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n/an/a 685n/an/an/an/an/an/a



Albert Ludwigs University Freiburg

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal GST/His6-tagged ABL2 (M1 to P650 residues) expressed in sf9 cells using Poly(Glu,Tyr) 4:1 as substrate aft...

J Nat Prod 82: 16-26 (2019)


Article DOI: 10.1021/acs.jnatprod.8b00233
BindingDB Entry DOI: 10.7270/Q2FX7DVS
More data for this
Ligand-Target Pair