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BDBM50090699 5-Hydroxy-1-methyl-7-phenyl-1H-[1,8]naphthyridin-2-one::5-hydroxy-1-methyl-7-phenyl-1,8-naphthyridin-2(1H)-one::CHEMBL328214

SMILES: Cn1c2nc(cc(O)c2ccc1=O)-c1ccccc1

InChI Key: InChIKey=NDIGDUKGZPJYJH-UHFFFAOYSA-N

Data: 7 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 7 hits for monomerid = 50090699   
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 A1 receptor


(BOVINE)
BDBM50090699
PNG
(5-Hydroxy-1-methyl-7-phenyl-1H-[1,8]naphthyridin-2...)
Show SMILES Cn1c2nc(cc(O)c2ccc1=O)-c1ccccc1
Show InChI InChI=1S/C15H12N2O2/c1-17-14(19)8-7-11-13(18)9-12(16-15(11)17)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,18)
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Article
PubMed
4.90E+3n/an/an/an/an/an/an/an/a



Università di Pisa

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A1 receptor in bovine cortical membranes using [3H]-CHA as radioligand


J Med Chem 47: 3019-31 (2004)


Article DOI: 10.1021/jm030977p
BindingDB Entry DOI: 10.7270/Q2BC3Z07
More data for this
Ligand-Target Pair
Adenosine A1 receptor


(BOVINE)
BDBM50090699
PNG
(5-Hydroxy-1-methyl-7-phenyl-1H-[1,8]naphthyridin-2...)
Show SMILES Cn1c2nc(cc(O)c2ccc1=O)-c1ccccc1
Show InChI InChI=1S/C15H12N2O2/c1-17-14(19)8-7-11-13(18)9-12(16-15(11)17)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,18)
PDB

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4.90E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Ability to displace the specific binding of [3H]CHA to adenosine A1 receptor from bovine brain cortical membranes


J Med Chem 43: 2814-23 (2000)


BindingDB Entry DOI: 10.7270/Q21R6R6K
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM50090699
PNG
(5-Hydroxy-1-methyl-7-phenyl-1H-[1,8]naphthyridin-2...)
Show SMILES Cn1c2nc(cc(O)c2ccc1=O)-c1ccccc1
Show InChI InChI=1S/C15H12N2O2/c1-17-14(19)8-7-11-13(18)9-12(16-15(11)17)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,18)
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PubMed
6.50E+3n/an/an/an/an/an/an/an/a



Università di Pisa

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in human striatal membranes using [3H]-CGS-21,680 as radioligand


J Med Chem 47: 3019-31 (2004)


Article DOI: 10.1021/jm030977p
BindingDB Entry DOI: 10.7270/Q2BC3Z07
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM50090699
PNG
(5-Hydroxy-1-methyl-7-phenyl-1H-[1,8]naphthyridin-2...)
Show SMILES Cn1c2nc(cc(O)c2ccc1=O)-c1ccccc1
Show InChI InChI=1S/C15H12N2O2/c1-17-14(19)8-7-11-13(18)9-12(16-15(11)17)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,18)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Ability to displace the specific binding of [3H]-CGS- to adenosine A2A receptor form bovine brain striatal membranes


J Med Chem 43: 2814-23 (2000)


BindingDB Entry DOI: 10.7270/Q21R6R6K
More data for this
Ligand-Target Pair
Adenosine receptor A2a and A3


(Rattus norvegicus)
BDBM50090699
PNG
(5-Hydroxy-1-methyl-7-phenyl-1H-[1,8]naphthyridin-2...)
Show SMILES Cn1c2nc(cc(O)c2ccc1=O)-c1ccccc1
Show InChI InChI=1S/C15H12N2O2/c1-17-14(19)8-7-11-13(18)9-12(16-15(11)17)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,18)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Ability to displace the specific binding of [3H](R)-PIA to adenosine A3 receptor from rat testis membranes


J Med Chem 43: 2814-23 (2000)


BindingDB Entry DOI: 10.7270/Q21R6R6K
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))
BDBM50090699
PNG
(5-Hydroxy-1-methyl-7-phenyl-1H-[1,8]naphthyridin-2...)
Show SMILES Cn1c2nc(cc(O)c2ccc1=O)-c1ccccc1
Show InChI InChI=1S/C15H12N2O2/c1-17-14(19)8-7-11-13(18)9-12(16-15(11)17)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,18)
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Università di Pisa

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A1 receptor in human cortical membranes using [3H]-CHA as radioligand


J Med Chem 47: 3019-31 (2004)


Article DOI: 10.1021/jm030977p
BindingDB Entry DOI: 10.7270/Q2BC3Z07
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM50090699
PNG
(5-Hydroxy-1-methyl-7-phenyl-1H-[1,8]naphthyridin-2...)
Show SMILES Cn1c2nc(cc(O)c2ccc1=O)-c1ccccc1
Show InChI InChI=1S/C15H12N2O2/c1-17-14(19)8-7-11-13(18)9-12(16-15(11)17)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,18)
PDB
MMDB

NCI pathway
Reactome pathway
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UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Università di Pisa

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in bovine striatal membranes using [3H]-CGS-21,680 as radioligand


J Med Chem 47: 3019-31 (2004)


Article DOI: 10.1021/jm030977p
BindingDB Entry DOI: 10.7270/Q2BC3Z07
More data for this
Ligand-Target Pair