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BDBM50034390 7-Hydroxy-3-methyl-1-(3-nitro-phenyl)-1H-chromeno[2,3-c]pyrazol-4-one::CHEMBL26636

SMILES: Cc1nn(-c2cccc(c2)[N+]([O-])=O)c2oc3cc(=[OH+])ccc3c([O-])c12

InChI Key: InChIKey=DAUQWMKIKYOFQV-UHFFFAOYSA-N

Data: 2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50034390   
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 A1


(Rattus norvegicus (rat))
BDBM50034390
PNG
(7-Hydroxy-3-methyl-1-(3-nitro-phenyl)-1H-chromeno[...)
Show SMILES Cc1nn(-c2cccc(c2)[N+]([O-])=O)c2oc3cc(=[OH+])ccc3c([O-])c12
Show InChI InChI=1S/C17H11N3O5/c1-9-15-16(22)13-6-5-12(21)8-14(13)25-17(15)19(18-9)10-3-2-4-11(7-10)20(23)24/h2-8,22H,1H3
PDB

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KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
360n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50034390
PNG
(7-Hydroxy-3-methyl-1-(3-nitro-phenyl)-1H-chromeno[...)
Show SMILES Cc1nn(-c2cccc(c2)[N+]([O-])=O)c2oc3cc(=[OH+])ccc3c([O-])c12
Show InChI InChI=1S/C17H11N3O5/c1-9-15-16(22)13-6-5-12(21)8-14(13)25-17(15)19(18-9)10-3-2-4-11(7-10)20(23)24/h2-8,22H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair