BDBM50273905 5-hydroxy-6-(4-hydroxyphenyl)-1,3-dipropyl-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione::CHEMBL455998

SMILES: CCCn1c2cc(-c3ccc(O)cc3)n(O)c2c(=O)n(CCC)c1=O

InChI Key: InChIKey=ZJZZCFUGJJVKFL-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 = 50273905   

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))	BDBM50273905 (5-hydroxy-6-(4-hydroxyphenyl)-1,3-dipropyl-1H-pyrr...) Show SMILES CCCn1c2cc(-c3ccc(O)cc3)n(O)c2c(=O)n(CCC)c1=O Show InChI InChI=1S/C18H21N3O4/c1-3-9-19-15-11-14(12-5-7-13(22)8-6-12)21(25)16(15)17(23)20(10-4-2)18(19)24/h5-8,11,22,25H,3-4,9-10H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	102	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi di Bari Curated by ChEMBL					Assay Description Displacement of [3H]ZM241385 from human cloned adenosine A2A receptor expressed in human HeLa cells				Bioorg Med Chem 16: 9780-9 (2008) Article DOI: 10.1016/j.bmc.2008.09.067 BindingDB Entry DOI: 10.7270/Q21Z448B
					More data for this Ligand-Target Pair
Adenosine receptor A2b (Homo sapiens (Human))	BDBM50273905 (5-hydroxy-6-(4-hydroxyphenyl)-1,3-dipropyl-1H-pyrr...) Show SMILES CCCn1c2cc(-c3ccc(O)cc3)n(O)c2c(=O)n(CCC)c1=O Show InChI InChI=1S/C18H21N3O4/c1-3-9-19-15-11-14(12-5-7-13(22)8-6-12)21(25)16(15)17(23)20(10-4-2)18(19)24/h5-8,11,22,25H,3-4,9-10H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	115	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi di Bari Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from human cloned adenosine A2B receptor expressed in HEK293 cells				Bioorg Med Chem 16: 9780-9 (2008) Article DOI: 10.1016/j.bmc.2008.09.067 BindingDB Entry DOI: 10.7270/Q21Z448B
					More data for this Ligand-Target Pair