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SMILES: COC(=O)[C@@H]1[C@H](c2cc(OC)c(OC)c(OC)c2)c2cc3OCOc3cc2C=C1c1nc2ccccc2[nH]1

InChI Key: InChIKey=VKNILQSMGKIRJJ-FTJBHMTQSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50058371   
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)		BDBM50058371
PNG
(CHEMBL3334924)
Show SMILES COC(=O)[C@@H]1[C@H](c2cc(OC)c(OC)c(OC)c2)c2cc3OCOc3cc2C=C1c1nc2ccccc2[nH]1 |r,c:30|
Show InChI InChI=1S/C29H26N2O7/c1-33-23-11-16(12-24(34-2)27(23)35-3)25-17-13-22-21(37-14-38-22)10-15(17)9-18(26(25)29(32)36-4)28-30-19-7-5-6-8-20(19)31-28/h5-13,25-26H,14H2,1-4H3,(H,30,31)/t25-,26+/m1/s1
UniProtKB/TrEMBL

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UniChem

Similars
Article
PubMed
n/an/a 1.29E+3n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research (NIPER)

Curated by ChEMBL


Assay Description
Inhibition of bovine brain tubulin polymerization by fluorescence analysis

Bioorg Med Chem 22: 5466-75 (2014)


Article DOI: 10.1016/j.bmc.2014.07.031
BindingDB Entry DOI: 10.7270/Q25D8TH0
More data for this
Ligand-Target Pair