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BDBM50091987 3-Hydroxy-naphthalene-2-carboxylic acid (4-methoxy-phenyl)-amide::CHEMBL63883::cid_66721

SMILES: COc1ccc(NC(=O)c2cc3ccccc3cc2O)cc1

InChI Key: InChIKey=UIXFPIHXQQZAGX-UHFFFAOYSA-N

Data: 8 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 8 hits for monomerid = 50091987   
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
SUMO-1-specific protease


(Homo sapiens (Human))
BDBM50091987
PNG
(3-Hydroxy-naphthalene-2-carboxylic acid (4-methoxy...)
Show SMILES COc1ccc(NC(=O)c2cc3ccccc3cc2O)cc1
Show InChI InChI=1S/C18H15NO3/c1-22-15-8-6-14(7-9-15)19-18(21)16-10-12-4-2-3-5-13(12)11-17(16)20/h2-11,20H,1H3,(H,19,21)
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PCBioAssay
n/an/a 7.26E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q27H1H10
More data for this
Ligand-Target Pair
Caspase-3


(Homo sapiens (Human))
BDBM50091987
PNG
(3-Hydroxy-naphthalene-2-carboxylic acid (4-methoxy...)
Show SMILES COc1ccc(NC(=O)c2cc3ccccc3cc2O)cc1
Show InChI InChI=1S/C18H15NO3/c1-22-15-8-6-14(7-9-15)19-18(21)16-10-12-4-2-3-5-13(12)11-17(16)20/h2-11,20H,1H3,(H,19,21)
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n/an/a 2.07E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2RJ4GZT
More data for this
Ligand-Target Pair
SUMO/sentrin specific peptidase family member 8


(Homo sapiens (Human))
BDBM50091987
PNG
(3-Hydroxy-naphthalene-2-carboxylic acid (4-methoxy...)
Show SMILES COc1ccc(NC(=O)c2cc3ccccc3cc2O)cc1
Show InChI InChI=1S/C18H15NO3/c1-22-15-8-6-14(7-9-15)19-18(21)16-10-12-4-2-3-5-13(12)11-17(16)20/h2-11,20H,1H3,(H,19,21)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MS3R7H
More data for this
Ligand-Target Pair
Human herpesvirus 6 DNA polymerase


(Human herpesvirus 6A (strain Uganda-1102) (HHV-6 v...)
BDBM50091987
PNG
(3-Hydroxy-naphthalene-2-carboxylic acid (4-methoxy...)
Show SMILES COc1ccc(NC(=O)c2cc3ccccc3cc2O)cc1
Show InChI InChI=1S/C18H15NO3/c1-22-15-8-6-14(7-9-15)19-18(21)16-10-12-4-2-3-5-13(12)11-17(16)20/h2-11,20H,1H3,(H,19,21)
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Article
PubMed
n/an/a 5.60E+4n/an/an/an/an/an/a



Pharmacia

Curated by ChEMBL


Assay Description
Inhibitory activity against Human Cytomegalovirus (HCMV) polymerase


Bioorg Med Chem Lett 10: 2079-81 (2000)


Article DOI: 10.1016/s0960-894x(00)00402-9
BindingDB Entry DOI: 10.7270/Q2222T0M
More data for this
Ligand-Target Pair
perilipin-5


(Homo sapiens (Human))
BDBM50091987
PNG
(3-Hydroxy-naphthalene-2-carboxylic acid (4-methoxy...)
Show SMILES COc1ccc(NC(=O)c2cc3ccccc3cc2O)cc1
Show InChI InChI=1S/C18H15NO3/c1-22-15-8-6-14(7-9-15)19-18(21)16-10-12-4-2-3-5-13(12)11-17(16)20/h2-11,20H,1H3,(H,19,21)
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n/an/a 1.24E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2ZP44QS
More data for this
Ligand-Target Pair
perilipin-1


(Homo sapiens (Human))
BDBM50091987
PNG
(3-Hydroxy-naphthalene-2-carboxylic acid (4-methoxy...)
Show SMILES COc1ccc(NC(=O)c2cc3ccccc3cc2O)cc1
Show InChI InChI=1S/C18H15NO3/c1-22-15-8-6-14(7-9-15)19-18(21)16-10-12-4-2-3-5-13(12)11-17(16)20/h2-11,20H,1H3,(H,19,21)
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n/an/a 1.17E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
perilipin-5


(Homo sapiens (Human))
BDBM50091987
PNG
(3-Hydroxy-naphthalene-2-carboxylic acid (4-methoxy...)
Show SMILES COc1ccc(NC(=O)c2cc3ccccc3cc2O)cc1
Show InChI InChI=1S/C18H15NO3/c1-22-15-8-6-14(7-9-15)19-18(21)16-10-12-4-2-3-5-13(12)11-17(16)20/h2-11,20H,1H3,(H,19,21)
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PCBioAssay
n/an/a 9.05E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q24B2ZW9
More data for this
Ligand-Target Pair
Hepatocyte nuclear factor 4-alpha


(Homo sapiens (Human))
BDBM50091987
PNG
(3-Hydroxy-naphthalene-2-carboxylic acid (4-methoxy...)
Show SMILES COc1ccc(NC(=O)c2cc3ccccc3cc2O)cc1
Show InChI InChI=1S/C18H15NO3/c1-22-15-8-6-14(7-9-15)19-18(21)16-10-12-4-2-3-5-13(12)11-17(16)20/h2-11,20H,1H3,(H,19,21)
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n/an/a 1.00E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2736PH3
More data for this
Ligand-Target Pair