BDBM50221692 2-(1,3-dimethyl-2,4-dioxo-1,2,3,4,7,8-hexahydropyrimido[1,2-a]purin-9(6H)-yl)ethyl 4-chlorophenylcarbamate::CHEMBL241595

SMILES: Cn1c2nc3N(CCOC(=O)Nc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O

InChI Key: InChIKey=RZHPVCDKKAUHOF-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 = 50221692   

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))	BDBM50221692 (2-(1,3-dimethyl-2,4-dioxo-1,2,3,4,7,8-hexahydropyr...) Show SMILES Cn1c2nc3N(CCOC(=O)Nc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O Show InChI InChI=1S/C19H21ClN6O4/c1-23-15-14(16(27)24(2)19(23)29)26-9-3-8-25(17(26)22-15)10-11-30-18(28)21-13-6-4-12(20)5-7-13/h4-7H,3,8-11H2,1-2H3,(H,21,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]MSX2 from adenosine A2A receptor in rat brain striatal membrane				Bioorg Med Chem 15: 6956-74 (2007) Article DOI: 10.1016/j.bmc.2007.07.051 BindingDB Entry DOI: 10.7270/Q26W99TB
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50221692 (2-(1,3-dimethyl-2,4-dioxo-1,2,3,4,7,8-hexahydropyr...) Show SMILES Cn1c2nc3N(CCOC(=O)Nc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O Show InChI InChI=1S/C19H21ClN6O4/c1-23-15-14(16(27)24(2)19(23)29)26-9-3-8-25(17(26)22-15)10-11-30-18(28)21-13-6-4-12(20)5-7-13/h4-7H,3,8-11H2,1-2H3,(H,21,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]CCPA from adenosine A1 receptor in rat brain cortical membrane				Bioorg Med Chem 15: 6956-74 (2007) Article DOI: 10.1016/j.bmc.2007.07.051 BindingDB Entry DOI: 10.7270/Q26W99TB
					More data for this Ligand-Target Pair