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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50539631   
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
Activated CDC42 kinase 1


(Homo sapiens (Human))		BDBM50539631
PNG
(CHEMBL4639091)
Show SMILES COc1cc(ccc1Nc1ncc2NC(=O)c3ccccc3N(C)c2n1)N1CCN(CCO)CC1
Show InChI InChI=1S/C25H29N7O3/c1-30-21-6-4-3-5-18(21)24(34)27-20-16-26-25(29-23(20)30)28-19-8-7-17(15-22(19)35-2)32-11-9-31(10-12-32)13-14-33/h3-8,15-16,33H,9-14H2,1-2H3,(H,27,34)(H,26,28,29)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 37n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of tracer 236 binding to recombinant human GST-tagged TNK2 catalytic domain (110 to 476 residues) expressed in baculovirus expression syst...

Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.126948
BindingDB Entry DOI: 10.7270/Q28G8Q7S
More data for this
Ligand-Target Pair