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BDBM50156384 CHEMBL3793564

SMILES: COc1cc(cc(OC)c1OC)-c1nnc2[nH]c(=O)c3ccccc3n12

InChI Key: InChIKey=XYPIMIOOXQLPBF-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50156384   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Similar to alpha-tubulin isoform 1


(Bos taurus)
BDBM50156384
PNG
(CHEMBL3793564)
Show SMILES COc1cc(cc(OC)c1OC)-c1nnc2[nH]c(=O)c3ccccc3n12
Show InChI InChI=1S/C18H16N4O4/c1-24-13-8-10(9-14(25-2)15(13)26-3)16-20-21-18-19-17(23)11-6-4-5-7-12(11)22(16)18/h4-9H,1-3H3,(H,19,21,23)
UniProtKB/TrEMBL

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Universities of Lille

Curated by ChEMBL


Assay Description
Inhibition of bovine tubulin polymerization after 1 hr by fluorescence spectrometry


Eur J Med Chem 115: 393-405 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.056
BindingDB Entry DOI: 10.7270/Q2RN39RQ
More data for this
Ligand-Target Pair