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BDBM50178495 5-(2-dimethylamino-ethoxy)-7,12-dioxo-7,12-dihydro-dinaphtho[1,2-b;2',3'-d]furan-6-carboxylic acid methylester::CHEMBL201865

SMILES: COC(=O)c1c(OCCN(C)C)c2ccccc2c2oc3c(C(=O)c4ccccc4C3=O)c12

InChI Key: InChIKey=LAGLTBCHFAHIEE-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 = 50178495   
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
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50178495
PNG
(5-(2-dimethylamino-ethoxy)-7,12-dioxo-7,12-dihydro...)
Show SMILES COC(=O)c1c(OCCN(C)C)c2ccccc2c2oc3c(C(=O)c4ccccc4C3=O)c12
Show InChI InChI=1S/C26H21NO6/c1-27(2)12-13-32-23-16-10-6-7-11-17(16)24-18(20(23)26(30)31-3)19-21(28)14-8-4-5-9-15(14)22(29)25(19)33-24/h4-11H,12-13H2,1-3H3
PDB
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PC cid
PC sid
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Article
PubMed
n/an/a 7.60E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory activity against PDGFRbeta kinase


Bioorg Med Chem Lett 16: 737-42 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.115
BindingDB Entry DOI: 10.7270/Q2SF2VQR
More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (Human))
BDBM50178495
PNG
(5-(2-dimethylamino-ethoxy)-7,12-dioxo-7,12-dihydro...)
Show SMILES COC(=O)c1c(OCCN(C)C)c2ccccc2c2oc3c(C(=O)c4ccccc4C3=O)c12
Show InChI InChI=1S/C26H21NO6/c1-27(2)12-13-32-23-16-10-6-7-11-17(16)24-18(20(23)26(30)31-3)19-21(28)14-8-4-5-9-15(14)22(29)25(19)33-24/h4-11H,12-13H2,1-3H3
PDB
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KEGG

UniProtKB/SwissProt

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GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.10E+4n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory activity against EGFR kinase


Bioorg Med Chem Lett 16: 737-42 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.115
BindingDB Entry DOI: 10.7270/Q2SF2VQR
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50178495
PNG
(5-(2-dimethylamino-ethoxy)-7,12-dioxo-7,12-dihydro...)
Show SMILES COC(=O)c1c(OCCN(C)C)c2ccccc2c2oc3c(C(=O)c4ccccc4C3=O)c12
Show InChI InChI=1S/C26H21NO6/c1-27(2)12-13-32-23-16-10-6-7-11-17(16)24-18(20(23)26(30)31-3)19-21(28)14-8-4-5-9-15(14)22(29)25(19)33-24/h4-11H,12-13H2,1-3H3
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PubMed
n/an/a 2.36E+4n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory activity against FGFR1 kinase


Bioorg Med Chem Lett 16: 737-42 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.115
BindingDB Entry DOI: 10.7270/Q2SF2VQR
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50178495
PNG
(5-(2-dimethylamino-ethoxy)-7,12-dioxo-7,12-dihydro...)
Show SMILES COC(=O)c1c(OCCN(C)C)c2ccccc2c2oc3c(C(=O)c4ccccc4C3=O)c12
Show InChI InChI=1S/C26H21NO6/c1-27(2)12-13-32-23-16-10-6-7-11-17(16)24-18(20(23)26(30)31-3)19-21(28)14-8-4-5-9-15(14)22(29)25(19)33-24/h4-11H,12-13H2,1-3H3
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Article
PubMed
n/an/a 1.30E+4n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory activity against VEGFR2 kinase


Bioorg Med Chem Lett 16: 737-42 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.115
BindingDB Entry DOI: 10.7270/Q2SF2VQR
More data for this
Ligand-Target Pair