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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tubulin beta-2B chain' and Ligand = 'BDBM50111567'   
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
Tubulin beta-2B chain


(Bos taurus)
BDBM50111567
PNG
(2-Methoxy-5-[4-(3,4,5-trimethoxy-phenyl)-oxazol-5-...)
Show SMILES COc1ccc(cc1O)-c1ocnc1-c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C19H19NO6/c1-22-14-6-5-11(7-13(14)21)18-17(20-10-26-18)12-8-15(23-2)19(25-4)16(9-12)24-3/h5-10,21H,1-4H3
PDB
MMDB

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PC cid
PC sid
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Similars

PubMed
n/an/a 980n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration needed to inhibit tubulin polymerization by 50%


J Med Chem 45: 1697-711 (2002)


BindingDB Entry DOI: 10.7270/Q2QJ7GKQ
More data for this
Ligand-Target Pair