BDBM50212813 9-benzhydryl-1,3-dimethyl-6,7,8,9-tetrahydropyrimido[1,2-a]purine-2,4(1H,3H)-dione::CHEMBL238636

SMILES: Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)C(c1ccccc1)c1ccccc1

InChI Key: InChIKey=VMNRJKSWPJXLCC-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 = 50212813   

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 Receptors A2a (A2a) (Rattus norvegicus (rat))	BDBM50212813 (9-benzhydryl-1,3-dimethyl-6,7,8,9-tetrahydropyrimi...) Show SMILES Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)C(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C23H23N5O2/c1-25-20-19(21(29)26(2)23(25)30)28-15-9-14-27(22(28)24-20)18(16-10-5-3-6-11-16)17-12-7-4-8-13-17/h3-8,10-13,18H,9,14-15H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Curated by ChEMBL					Assay Description Displacement of [3H]MSX2 from adenosine A2A receptor in rat striatal membrane				Bioorg Med Chem 15: 5003-17 (2007) Article DOI: 10.1016/j.bmc.2007.04.018 BindingDB Entry DOI: 10.7270/Q2833RR7
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50212813 (9-benzhydryl-1,3-dimethyl-6,7,8,9-tetrahydropyrimi...) Show SMILES Cn1c2nc3N(CCCn3c2c(=O)n(C)c1=O)C(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C23H23N5O2/c1-25-20-19(21(29)26(2)23(25)30)28-15-9-14-27(22(28)24-20)18(16-10-5-3-6-11-16)17-12-7-4-8-13-17/h3-8,10-13,18H,9,14-15H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Curated by ChEMBL					Assay Description Displacement of [3H]CCPA from adenosine A1 receptor in rat brain cortical membrane				Bioorg Med Chem 15: 5003-17 (2007) Article DOI: 10.1016/j.bmc.2007.04.018 BindingDB Entry DOI: 10.7270/Q2833RR7
					More data for this Ligand-Target Pair