BindingDB logo
myBDB logout

BDBM50102281 10-Benzyl-3-(4-hydroxy-phenyl)-10H-benzo[4,5]imidazo[2,1-c][1,2,4]triazin-4-one::CHEMBL109691

SMILES: Oc1ccc(cc1)-c1nnc2n(Cc3ccccc3)c3ccccc3n2c1=O

InChI Key: InChIKey=JYELSORFHCQDSM-UHFFFAOYSA-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 = 50102281   
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)
BDBM50102281
PNG
(10-Benzyl-3-(4-hydroxy-phenyl)-10H-benzo[4,5]imida...)
Show SMILES Oc1ccc(cc1)-c1nnc2n(Cc3ccccc3)c3ccccc3n2c1=O
Show InChI InChI=1S/C22H16N4O2/c27-17-12-10-16(11-13-17)20-21(28)26-19-9-5-4-8-18(19)25(22(26)24-23-20)14-15-6-2-1-3-7-15/h1-13,27H,14H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
344n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CHA from adenosine A1 receptors was determined in bovine cortical membranes


J Med Chem 44: 316-27 (2001)


Article DOI: 10.1021/jm001054m
BindingDB Entry DOI: 10.7270/Q2D79C4H
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM50102281
PNG
(10-Benzyl-3-(4-hydroxy-phenyl)-10H-benzo[4,5]imida...)
Show SMILES Oc1ccc(cc1)-c1nnc2n(Cc3ccccc3)c3ccccc3n2c1=O
Show InChI InChI=1S/C22H16N4O2/c27-17-12-10-16(11-13-17)20-21(28)26-19-9-5-4-8-18(19)25(22(26)24-23-20)14-15-6-2-1-3-7-15/h1-13,27H,14H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.20E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGS- 21680 from adenosine A2a receptor of bovine striatal membrane


J Med Chem 44: 316-27 (2001)


Article DOI: 10.1021/jm001054m
BindingDB Entry DOI: 10.7270/Q2D79C4H
More data for this
Ligand-Target Pair