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SMILES: COc1cc(O)c(-c2c(O)cc(OC)c3c2ccc2cc(O)ccc32)c2ccc3cc(O)ccc3c12

InChI Key: InChIKey=CNLFNDMTGHNGIV-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50160804   
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
Tubulin beta chain [1-43]


(Leishmania donovani)		BDBM50160804
PNG
(4,4''-Dimethoxy-[1,1'']biphenanthrenyl-2,7,2'',7''...)
Show SMILES COc1cc(O)c(-c2c(O)cc(OC)c3c2ccc2cc(O)ccc32)c2ccc3cc(O)ccc3c12 |(21.69,-24.1,;23.24,-24.11,;24.03,-22.77,;25.57,-22.77,;26.34,-21.43,;27.89,-21.43,;25.56,-20.11,;26.34,-18.76,;25.56,-17.43,;24,-17.44,;26.32,-16.09,;27.88,-16.08,;28.65,-14.73,;30.2,-14.73,;28.66,-17.42,;27.88,-18.76,;28.65,-20.1,;30.2,-20.1,;30.96,-18.75,;32.5,-18.75,;33.27,-17.42,;34.82,-17.42,;32.49,-16.09,;30.96,-16.1,;30.2,-17.42,;24.03,-20.11,;23.25,-18.77,;21.72,-18.78,;20.95,-20.11,;19.42,-20.11,;18.65,-21.43,;17.1,-21.43,;19.41,-22.77,;20.95,-22.78,;21.72,-21.44,;23.26,-21.44,)|
Show InChI InChI=1S/C30H22O6/c1-35-25-13-23(33)29(21-7-3-15-11-17(31)5-9-19(15)27(21)25)30-22-8-4-16-12-18(32)6-10-20(16)28(22)26(36-2)14-24(30)34/h3-14,31-34H,1-2H3
UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 3.00E+4n/an/an/an/an/an/a



Hokkaido University

Curated by ChEMBL


Assay Description
Inhibition of tubulin polymerization interacting at the colchicine binding site.

Bioorg Med Chem Lett 15: 1051-4 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.026
BindingDB Entry DOI: 10.7270/Q22Z151S
More data for this
Ligand-Target Pair