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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Aurora kinase B' and Ligand = 'BDBM50052023'   
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
Aurora kinase B


(Homo sapiens (Human))
BDBM50052023
PNG
(CHEMBL3322581)
Show SMILES Cc1[nH]c(\C=C2/C(=O)Nc3cc(NC(=O)c4cccn(-c5ccc(F)cc5)c4=O)ccc23)c(C)c1C(O)=O
Show InChI InChI=1S/C28H21FN4O5/c1-14-22(30-15(2)24(14)28(37)38)13-21-19-10-7-17(12-23(19)32-26(21)35)31-25(34)20-4-3-11-33(27(20)36)18-8-5-16(29)6-9-18/h3-13,30H,1-2H3,(H,31,34)(H,32,35)(H,37,38)/b21-13-
PDB

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Similars

Article
PubMed
n/an/a 11n/an/an/an/an/an/a



National Taiwan University

Curated by ChEMBL


Assay Description
Inhibition of Aurora B (unknown origin) using H-LRRASLG substrate by radioisotope-based P81 filter-binding assay


Eur J Med Chem 84: 312-34 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.033
BindingDB Entry DOI: 10.7270/Q2RV0QB7
More data for this
Ligand-Target Pair