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SMILES: COc1ccc(cc1)-c1cc(=O)c2cc3ccoc3cc2o1

InChI Key: InChIKey=WXBAKLJXQYICHT-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 4 hits for monomerid = 50198349   
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
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50198349
PNG
(7-(4-methoxy-phenyl)-furo[3,2-g]chromen-5-one | CH...)
Show SMILES COc1ccc(cc1)-c1cc(=O)c2cc3ccoc3cc2o1
Show InChI InChI=1S/C18H12O4/c1-20-13-4-2-11(3-5-13)17-9-15(19)14-8-12-6-7-21-16(12)10-18(14)22-17/h2-10H,1H3
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PC cid
PC sid
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Similars

Article
PubMed
3.00E+4n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of PTP1B


Bioorg Med Chem 15: 727-34 (2006)


Article DOI: 10.1016/j.bmc.2006.10.053
BindingDB Entry DOI: 10.7270/Q2CR5T1W
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50198349
PNG
(7-(4-methoxy-phenyl)-furo[3,2-g]chromen-5-one | CH...)
Show SMILES COc1ccc(cc1)-c1cc(=O)c2cc3ccoc3cc2o1
Show InChI InChI=1S/C18H12O4/c1-20-13-4-2-11(3-5-13)17-9-15(19)14-8-12-6-7-21-16(12)10-18(14)22-17/h2-10H,1H3
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Article
PubMed
3.60E+4n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of PTP1B in presence of 0.01% Triton X-100


Bioorg Med Chem 15: 727-34 (2006)


Article DOI: 10.1016/j.bmc.2006.10.053
BindingDB Entry DOI: 10.7270/Q2CR5T1W
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50198349
PNG
(7-(4-methoxy-phenyl)-furo[3,2-g]chromen-5-one | CH...)
Show SMILES COc1ccc(cc1)-c1cc(=O)c2cc3ccoc3cc2o1
Show InChI InChI=1S/C18H12O4/c1-20-13-4-2-11(3-5-13)17-9-15(19)14-8-12-6-7-21-16(12)10-18(14)22-17/h2-10H,1H3
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Article
PubMed
n/an/a 7.25E+4n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of PTP1B


Bioorg Med Chem 15: 727-34 (2006)


Article DOI: 10.1016/j.bmc.2006.10.053
BindingDB Entry DOI: 10.7270/Q2CR5T1W
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50198349
PNG
(7-(4-methoxy-phenyl)-furo[3,2-g]chromen-5-one | CH...)
Show SMILES COc1ccc(cc1)-c1cc(=O)c2cc3ccoc3cc2o1
Show InChI InChI=1S/C18H12O4/c1-20-13-4-2-11(3-5-13)17-9-15(19)14-8-12-6-7-21-16(12)10-18(14)22-17/h2-10H,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
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antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.88E+4n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of PTP1B in presence of 0.01% Triton X-100


Bioorg Med Chem 15: 727-34 (2006)


Article DOI: 10.1016/j.bmc.2006.10.053
BindingDB Entry DOI: 10.7270/Q2CR5T1W
More data for this
Ligand-Target Pair