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BDBM50041113 2-(3-Methoxy-phenyl)-1H-quinolin-4-one::CHEMBL276340

SMILES: COc1cccc(c1)-c1cc(O)c2ccccc2n1

InChI Key: InChIKey=NINMRZJWLHKQKT-UHFFFAOYSA-N

Data: 4 IC50

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 4 hits for monomerid = 50041113   
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


(Bos taurus)
BDBM50041113
PNG
(2-(3-Methoxy-phenyl)-1H-quinolin-4-one | CHEMBL276...)
Show SMILES COc1cccc(c1)-c1cc(O)c2ccccc2n1
Show InChI InChI=1S/C16H13NO2/c1-19-12-6-4-5-11(9-12)15-10-16(18)13-7-2-3-8-14(13)17-15/h2-10H,1H3,(H,17,18)
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PubMed
n/an/a 1.40E+3n/an/an/an/an/an/a



School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of tubulin polymerization


J Med Chem 37: 1126-35 (1994)


BindingDB Entry DOI: 10.7270/Q2ZC81XN
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)
BDBM50041113
PNG
(2-(3-Methoxy-phenyl)-1H-quinolin-4-one | CHEMBL276...)
Show SMILES COc1cccc(c1)-c1cc(O)c2ccccc2n1
Show InChI InChI=1S/C16H13NO2/c1-19-12-6-4-5-11(9-12)15-10-16(18)13-7-2-3-8-14(13)17-15/h2-10H,1H3,(H,17,18)
UniProtKB/TrEMBL

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Article
PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of bovine brain tubulin polymerization (ITP).


J Med Chem 41: 1155-62 (1998)


Article DOI: 10.1021/jm9707479
BindingDB Entry DOI: 10.7270/Q2RN3BKW
More data for this
Ligand-Target Pair
Tubulin


(Sus scrofa (Pig))
BDBM50041113
PNG
(2-(3-Methoxy-phenyl)-1H-quinolin-4-one | CHEMBL276...)
Show SMILES COc1cccc(c1)-c1cc(O)c2ccccc2n1
Show InChI InChI=1S/C16H13NO2/c1-19-12-6-4-5-11(9-12)15-10-16(18)13-7-2-3-8-14(13)17-15/h2-10H,1H3,(H,17,18)
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PubMed
n/an/a 1.41E+3n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


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


J Med Chem 43: 167-76 (2000)


BindingDB Entry DOI: 10.7270/Q2CV4JZB
More data for this
Ligand-Target Pair
Tubulin


(Bos taurus)
BDBM50041113
PNG
(2-(3-Methoxy-phenyl)-1H-quinolin-4-one | CHEMBL276...)
Show SMILES COc1cccc(c1)-c1cc(O)c2ccccc2n1
Show InChI InChI=1S/C16H13NO2/c1-19-12-6-4-5-11(9-12)15-10-16(18)13-7-2-3-8-14(13)17-15/h2-10H,1H3,(H,17,18)
PDB
MMDB

Reactome pathway
KEGG

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.40E+3n/an/an/an/an/an/a



University of North Carolina at Chapel Hill 27599

Curated by ChEMBL


Assay Description
Inhibition of bovine tubulin polymerization


J Med Chem 40: 2266-75 (1997)


Article DOI: 10.1021/jm960858s
BindingDB Entry DOI: 10.7270/Q26M35ZF
More data for this
Ligand-Target Pair