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BDBM50051335 4-Methoxy-7-[(E)-phenyliminomethyl]-furo[3,2-g]chromen-5-one::CHEMBL74489

SMILES: COc1c2ccoc2cc2oc(\C=N\c3ccccc3)cc(=O)c12

InChI Key: InChIKey=GHZCBCUGMGHTJF-RGVLZGJSSA-N

Data: 2 KI

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 2 hits for monomerid = 50051335   
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
Adenosine receptor A3


(Homo sapiens (Human))
BDBM50051335
PNG
(4-Methoxy-7-[(E)-phenyliminomethyl]-furo[3,2-g]chr...)
Show SMILES COc1c2ccoc2cc2oc(\C=N\c3ccccc3)cc(=O)c12
Show InChI InChI=1S/C19H13NO4/c1-22-19-14-7-8-23-16(14)10-17-18(19)15(21)9-13(24-17)11-20-12-5-3-2-4-6-12/h2-11H,1H3/b20-11+
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
9.12E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Ability to displace [125I]-AB-MECA binding from adenosine A3 receptor.


J Med Chem 41: 46-52 (1998)

Checked by Author
Article DOI: 10.1021/jm970446z
BindingDB Entry DOI: 10.7270/Q2NC62QT
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))
BDBM50051335
PNG
(4-Methoxy-7-[(E)-phenyliminomethyl]-furo[3,2-g]chr...)
Show SMILES COc1c2ccoc2cc2oc(\C=N\c3ccccc3)cc(=O)c12
Show InChI InChI=1S/C19H13NO4/c1-22-19-14-7-8-23-16(14)10-17-18(19)15(21)9-13(24-17)11-20-12-5-3-2-4-6-12/h2-11H,1H3/b20-11+
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
9.18E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against human adenosine A3 receptor in HEK293 cells using [125I]-AB-MECA 21680 radioligand.


J Med Chem 39: 2293-301 (1996)


Article DOI: 10.1021/jm950923i
BindingDB Entry DOI: 10.7270/Q2D799J2
More data for this
Ligand-Target Pair