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SMILES: COc1ccc(cc1O)C1CCc2cc(OC)c(OC)c(OC)c12

InChI Key: InChIKey=QYUAUFKQRRPTIK-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50217336   
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)
BDBM50217336
PNG
(CHEMBL131684)
Show SMILES COc1ccc(cc1O)C1CCc2cc(OC)c(OC)c(OC)c12
Show InChI InChI=1S/C19H22O5/c1-21-15-8-6-11(9-14(15)20)13-7-5-12-10-16(22-2)18(23-3)19(24-4)17(12)13/h6,8-10,13,20H,5,7H2,1-4H3
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 1.09E+4n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of tubulin polymerization activity using homogenous bovine brain tubulin at 37 degree C


Bioorg Med Chem Lett 9: 407-12 (1999)


BindingDB Entry DOI: 10.7270/Q2BG2R5N
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)
BDBM50217336
PNG
(CHEMBL131684)
Show SMILES COc1ccc(cc1O)C1CCc2cc(OC)c(OC)c(OC)c12
Show InChI InChI=1S/C19H22O5/c1-21-15-8-6-11(9-14(15)20)13-7-5-12-10-16(22-2)18(23-3)19(24-4)17(12)13/h6,8-10,13,20H,5,7H2,1-4H3
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 1.09E+4n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of tubulin polymerization activity using homogenous bovine brain tubulin at 45 degree C


Bioorg Med Chem Lett 9: 407-12 (1999)


BindingDB Entry DOI: 10.7270/Q2BG2R5N
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)
BDBM50217336
PNG
(CHEMBL131684)
Show SMILES COc1ccc(cc1O)C1CCc2cc(OC)c(OC)c(OC)c12
Show InChI InChI=1S/C19H22O5/c1-21-15-8-6-11(9-14(15)20)13-7-5-12-10-16(22-2)18(23-3)19(24-4)17(12)13/h6,8-10,13,20H,5,7H2,1-4H3
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 1.18E+4n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of tubulin polymerization activity using homogenous bovine brain tubulin at 30 degree C


Bioorg Med Chem Lett 9: 407-12 (1999)


BindingDB Entry DOI: 10.7270/Q2BG2R5N
More data for this
Ligand-Target Pair