BDBM50041581 1,3,5-Trimethyl-6-((E)-styryl)-1,5-dihydro-pyrrolo[3,2-d]pyrimidine-2,4-dione::CHEMBL39898

SMILES: Cn1c(\C=C\c2ccccc2)cc2n(C)c(=O)n(C)c(=O)c12

InChI Key: InChIKey=CPTGMMDIEVVMQA-MDZDMXLPSA-N

Data: 2 KI  1 IC50

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 = 50041581   

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))	BDBM50041581 (1,3,5-Trimethyl-6-((E)-styryl)-1,5-dihydro-pyrrolo...) Show SMILES Cn1c(\C=C\c2ccccc2)cc2n(C)c(=O)n(C)c(=O)c12 Show InChI InChI=1S/C17H17N3O2/c1-18-13(10-9-12-7-5-4-6-8-12)11-14-15(18)16(21)20(3)17(22)19(14)2/h4-11H,1-3H3/b10-9+	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	170	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Parma Curated by ChEMBL					Assay Description Displacement of [3H]ZM241385 from human adenosine A2A receptor expressed in HEK293 cells after 1 hr by microbeta scintillation counting analysis				J Med Chem 56: 1247-61 (2013) Article DOI: 10.1021/jm301686s BindingDB Entry DOI: 10.7270/Q2SB472H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50041581 (1,3,5-Trimethyl-6-((E)-styryl)-1,5-dihydro-pyrrolo...) Show SMILES Cn1c(\C=C\c2ccccc2)cc2n(C)c(=O)n(C)c(=O)c12 Show InChI InChI=1S/C17H17N3O2/c1-18-13(10-9-12-7-5-4-6-8-12)11-14-15(18)16(21)20(3)17(22)19(14)2/h4-11H,1-3H3/b10-9+	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Eberhard-Karls-Universität Tübingen Curated by ChEMBL					Assay Description Binding affinity to A1 adenosine receptor from rat cortical membrane in presence of [3H]-R-(phenylisopropyl)-adenosine				J Med Chem 37: 1526-34 (1994) BindingDB Entry DOI: 10.7270/Q28P5ZJN
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50041581 (1,3,5-Trimethyl-6-((E)-styryl)-1,5-dihydro-pyrrolo...) Show SMILES Cn1c(\C=C\c2ccccc2)cc2n(C)c(=O)n(C)c(=O)c12 Show InChI InChI=1S/C17H17N3O2/c1-18-13(10-9-12-7-5-4-6-8-12)11-14-15(18)16(21)20(3)17(22)19(14)2/h4-11H,1-3H3/b10-9+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.58E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Parma Curated by ChEMBL					Assay Description Inhibition of human MAOB after 1 hr by luminescence assay				J Med Chem 56: 1247-61 (2013) Article DOI: 10.1021/jm301686s BindingDB Entry DOI: 10.7270/Q2SB472H
					More data for this Ligand-Target Pair