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BDBM76133 MLS001207566::N-(2,4-Dimethoxy-benzylidene)-N'-(6-methoxy-2-methyl-quinolin-4-yl)-hydrazine::N-[(2,4-dimethoxyphenyl)methylideneamino]-6-methoxy-2-methyl-4-quinolinamine::N-[(2,4-dimethoxyphenyl)methylideneamino]-6-methoxy-2-methyl-quinolin-4-amine::N-[(2,4-dimethoxyphenyl)methylideneamino]-6-methoxy-2-methylquinolin-4-amine::SMR000517672::[(2,4-dimethoxybenzylidene)amino]-(6-methoxy-2-methyl-4-quinolyl)amine::cid_3141523

SMILES: COc1ccc(CN=Nc2cc(C)nc3ccc(OC)cc23)c(OC)c1

InChI Key: InChIKey=UQEWOOUFXYBCTN-UHFFFAOYSA-N

Data: 3 IC50  2 EC50

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 5 hits for monomerid = 76133   
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
Angiotensin II receptor


(Homo sapiens (Human))
BDBM76133
PNG
(MLS001207566 | N-(2,4-Dimethoxy-benzylidene)-N'...)
Show SMILES COc1ccc(CN=Nc2cc(C)nc3ccc(OC)cc23)c(OC)c1 |w:8.8|
Show InChI InChI=1S/C20H21N3O3/c1-13-9-19(17-10-15(24-2)7-8-18(17)22-13)23-21-12-14-5-6-16(25-3)11-20(14)26-4/h5-11H,12H2,1-4H3
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PCBioAssay
n/an/an/an/a>1.00E+5n/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) Ne...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2PR7TFT
More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens (Human))
BDBM76133
PNG
(MLS001207566 | N-(2,4-Dimethoxy-benzylidene)-N'...)
Show SMILES COc1ccc(CN=Nc2cc(C)nc3ccc(OC)cc23)c(OC)c1 |w:8.8|
Show InChI InChI=1S/C20H21N3O3/c1-13-9-19(17-10-15(24-2)7-8-18(17)22-13)23-21-12-14-5-6-16(25-3)11-20(14)26-4/h5-11H,12H2,1-4H3
PDB
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n/an/a 9.10E+3n/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 CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2X34VX0
More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens (Human))
BDBM76133
PNG
(MLS001207566 | N-(2,4-Dimethoxy-benzylidene)-N'...)
Show SMILES COc1ccc(CN=Nc2cc(C)nc3ccc(OC)cc23)c(OC)c1 |w:8.8|
Show InChI InChI=1S/C20H21N3O3/c1-13-9-19(17-10-15(24-2)7-8-18(17)22-13)23-21-12-14-5-6-16(25-3)11-20(14)26-4/h5-11H,12H2,1-4H3
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n/an/a 6.39E+3n/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 CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2SB4462
More data for this
Ligand-Target Pair
Bfl-1


(Mus musculus (Mouse))
BDBM76133
PNG
(MLS001207566 | N-(2,4-Dimethoxy-benzylidene)-N'...)
Show SMILES COc1ccc(CN=Nc2cc(C)nc3ccc(OC)cc23)c(OC)c1 |w:8.8|
Show InChI InChI=1S/C20H21N3O3/c1-13-9-19(17-10-15(24-2)7-8-18(17)22-13)23-21-12-14-5-6-16(25-3)11-20(14)26-4/h5-11H,12H2,1-4H3
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n/an/a 1.14E+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 CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q25D8Q92
More data for this
Ligand-Target Pair
Apelin receptor


(Homo sapiens (Human))
BDBM76133
PNG
(MLS001207566 | N-(2,4-Dimethoxy-benzylidene)-N'...)
Show SMILES COc1ccc(CN=Nc2cc(C)nc3ccc(OC)cc23)c(OC)c1 |w:8.8|
Show InChI InChI=1S/C20H21N3O3/c1-13-9-19(17-10-15(24-2)7-8-18(17)22-13)23-21-12-14-5-6-16(25-3)11-20(14)26-4/h5-11H,12H2,1-4H3
PDB

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KEGG

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B.MOAD
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PC cid
PC sid
UniChem

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n/an/an/an/a>1.00E+5n/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) Ne...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2NV9GP9
More data for this
Ligand-Target Pair