BDBM50189815 6-amino-4-benzamido-1,2-dihydro-2-(4-methoxyphenyl)-1,2,4-triazolo[4,3-a]quinoxalin-1-one::CHEMBL209122

SMILES: COc1ccc(cc1)-n1nc2c(NC(=O)c3ccccc3)nc3c(N)cccc3n2c1=O

InChI Key: InChIKey=JCJKDJKCTJXHPY-UHFFFAOYSA-N

Data: 2 KI  2 IC50

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 = 50189815   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189815 (6-amino-4-benzamido-1,2-dihydro-2-(4-methoxyphenyl...) Show SMILES COc1ccc(cc1)-n1nc2c(NC(=O)c3ccccc3)nc3c(N)cccc3n2c1=O Show InChI InChI=1S/C23H18N6O3/c1-32-16-12-10-15(11-13-16)29-23(31)28-18-9-5-8-17(24)19(18)25-20(21(28)27-29)26-22(30)14-6-3-2-4-7-14/h2-13H,24H2,1H3,(H,25,26,30)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Firenze Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 49: 3916-25 (2006) Article DOI: 10.1021/jm060373w BindingDB Entry DOI: 10.7270/Q25H7FW1
					More data for this Ligand-Target Pair
Adenosine A1 receptor (BOVINE)	BDBM50189815 (6-amino-4-benzamido-1,2-dihydro-2-(4-methoxyphenyl...) Show SMILES COc1ccc(cc1)-n1nc2c(NC(=O)c3ccccc3)nc3c(N)cccc3n2c1=O Show InChI InChI=1S/C23H18N6O3/c1-32-16-12-10-15(11-13-16)29-23(31)28-18-9-5-8-17(24)19(18)25-20(21(28)27-29)26-22(30)14-6-3-2-4-7-14/h2-13H,24H2,1H3,(H,25,26,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	393	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Firenze Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from adenosine A1 receptor in bovine brain membranes				J Med Chem 49: 3916-25 (2006) Article DOI: 10.1021/jm060373w BindingDB Entry DOI: 10.7270/Q25H7FW1
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50189815 (6-amino-4-benzamido-1,2-dihydro-2-(4-methoxyphenyl...) Show SMILES COc1ccc(cc1)-n1nc2c(NC(=O)c3ccccc3)nc3c(N)cccc3n2c1=O Show InChI InChI=1S/C23H18N6O3/c1-32-16-12-10-15(11-13-16)29-23(31)28-18-9-5-8-17(24)19(18)25-20(21(28)27-29)26-22(30)14-6-3-2-4-7-14/h2-13H,24H2,1H3,(H,25,26,30)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.60	n/a	n/a	n/a	n/a	n/a	n/a
Università di Firenze Curated by ChEMBL					Assay Description Antagonist activity against Cl-IB-MECA inhibited cAMP level in CHO cells transfected with human A3 receptor				J Med Chem 49: 3916-25 (2006) Article DOI: 10.1021/jm060373w BindingDB Entry DOI: 10.7270/Q25H7FW1
					More data for this Ligand-Target Pair
Adenosine receptor A2b (Homo sapiens (Human))	BDBM50189815 (6-amino-4-benzamido-1,2-dihydro-2-(4-methoxyphenyl...) Show SMILES COc1ccc(cc1)-n1nc2c(NC(=O)c3ccccc3)nc3c(N)cccc3n2c1=O Show InChI InChI=1S/C23H18N6O3/c1-32-16-12-10-15(11-13-16)29-23(31)28-18-9-5-8-17(24)19(18)25-20(21(28)27-29)26-22(30)14-6-3-2-4-7-14/h2-13H,24H2,1H3,(H,25,26,30)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Università di Firenze Curated by ChEMBL					Assay Description Inhibition of NECA-stimulated cAMP level in CHO cells transfected with human adenosine A2B receptor				J Med Chem 49: 3916-25 (2006) Article DOI: 10.1021/jm060373w BindingDB Entry DOI: 10.7270/Q25H7FW1
					More data for this Ligand-Target Pair