BDBM50120756 1-(7-Methyl-2-phenyl-imidazo[1,2-a][1,3,5]triazin-4-ylamino)-butan-2-one::CHEMBL357024

SMILES: CCC(=O)CNc1nc(nc2nc(C)cn12)-c1ccccc1

InChI Key: InChIKey=UNEJRXOOCSPBHJ-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50120756   

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 A2a (Homo sapiens (Human))	BDBM50120756 (1-(7-Methyl-2-phenyl-imidazo[1,2-a][1,3,5]triazin-...) Show SMILES CCC(=O)CNc1nc(nc2nc(C)cn12)-c1ccccc1 Show InChI InChI=1S/C16H17N5O/c1-3-13(22)9-17-15-19-14(12-7-5-4-6-8-12)20-16-18-11(2)10-21(15)16/h4-8,10H,3,9H2,1-2H3,(H,17,18,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]- CGS-21,680 from Adenosine A2a receptor in bovine striatal membranes.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50120756 (1-(7-Methyl-2-phenyl-imidazo[1,2-a][1,3,5]triazin-...) Show SMILES CCC(=O)CNc1nc(nc2nc(C)cn12)-c1ccccc1 Show InChI InChI=1S/C16H17N5O/c1-3-13(22)9-17-15-19-14(12-7-5-4-6-8-12)20-16-18-11(2)10-21(15)16/h4-8,10H,3,9H2,1-2H3,(H,17,18,19,20)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [125I]-AB-MECA from Adenosine A3 receptor in bovine cortical membranes in the presence of 20 nM DPCPX.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair
Adenosine A1 receptor (BOVINE)	BDBM50120756 (1-(7-Methyl-2-phenyl-imidazo[1,2-a][1,3,5]triazin-...) Show SMILES CCC(=O)CNc1nc(nc2nc(C)cn12)-c1ccccc1 Show InChI InChI=1S/C16H17N5O/c1-3-13(22)9-17-15-19-14(12-7-5-4-6-8-12)20-16-18-11(2)10-21(15)16/h4-8,10H,3,9H2,1-2H3,(H,17,18,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]-CHA from Adenosine A1 receptor in bovine cortical membranes.				J Med Chem 45: 5030-6 (2002) BindingDB Entry DOI: 10.7270/Q2JH3KHN
					More data for this Ligand-Target Pair