BDBM50322850 2-(7-methoxy-4-methylquinazolin-2-ylamino)-1H-imidazol-5(4H)-one::CHEMBL1210817

SMILES: COc1ccc2c(C)nc(Nc3nc(O)c[nH]3)nc2c1

InChI Key: InChIKey=CIMLPSCQANEZLG-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 = 50322850   

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 A2b (Homo sapiens (Human))	BDBM50322850 (2-(7-methoxy-4-methylquinazolin-2-ylamino)-1H-imid...) Show SMILES COc1ccc2c(C)nc(Nc3nc(O)c[nH]3)nc2c1 Show InChI InChI=1S/C13H13N5O2/c1-7-9-4-3-8(20-2)5-10(9)16-13(15-7)18-12-14-6-11(19)17-12/h3-6,19H,1-2H3,(H2,14,15,16,17,18)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	112	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
East China University of Science and Technology Curated by ChEMBL					Assay Description Antagonist activity against human adenosine A2B receptor				Eur J Med Chem 45: 3459-71 (2010) Article DOI: 10.1016/j.ejmech.2010.04.039 BindingDB Entry DOI: 10.7270/Q2K074GG
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50322850 (2-(7-methoxy-4-methylquinazolin-2-ylamino)-1H-imid...) Show SMILES COc1ccc2c(C)nc(Nc3nc(O)c[nH]3)nc2c1 Show InChI InChI=1S/C13H13N5O2/c1-7-9-4-3-8(20-2)5-10(9)16-13(15-7)18-12-14-6-11(19)17-12/h3-6,19H,1-2H3,(H2,14,15,16,17,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.29E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
East China University of Science and Technology Curated by ChEMBL					Assay Description Antagonist activity against rat adenosine A1 receptor				Eur J Med Chem 45: 3459-71 (2010) Article DOI: 10.1016/j.ejmech.2010.04.039 BindingDB Entry DOI: 10.7270/Q2K074GG
					More data for this Ligand-Target Pair
Adenosine Receptors A2a (A2a) (Rattus norvegicus (rat))	BDBM50322850 (2-(7-methoxy-4-methylquinazolin-2-ylamino)-1H-imid...) Show SMILES COc1ccc2c(C)nc(Nc3nc(O)c[nH]3)nc2c1 Show InChI InChI=1S/C13H13N5O2/c1-7-9-4-3-8(20-2)5-10(9)16-13(15-7)18-12-14-6-11(19)17-12/h3-6,19H,1-2H3,(H2,14,15,16,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
East China University of Science and Technology Curated by ChEMBL					Assay Description Antagonist activity against rat adenosine A2A receptor				Eur J Med Chem 45: 3459-71 (2010) Article DOI: 10.1016/j.ejmech.2010.04.039 BindingDB Entry DOI: 10.7270/Q2K074GG
					More data for this Ligand-Target Pair