BDBM43365 8-Bromo-3-methyl-7-(3-phenyl-propyl)-3,7-dihydro-purine-2,6-dione::8-bromanyl-3-methyl-7-(3-phenylpropyl)purine-2,6-dione::8-bromo-3-methyl-7-(3-phenylpropyl)purine-2,6-dione::8-bromo-3-methyl-7-(3-phenylpropyl)xanthine::MLS000527626::SMR000118100::cid_1119323

SMILES: Cn1c2nc(Br)n(CCCc3ccccc3)c2c(=O)[nH]c1=O

InChI Key: InChIKey=RXKCKKUYDBEQFO-UHFFFAOYSA-N

Data: 1 EC50

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 1 hit for monomerid = 43365   

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
MDM2-MDMX (Homo sapiens (Human))	BDBM43365 (8-Bromo-3-methyl-7-(3-phenyl-propyl)-3,7-dihydro-p...) Show SMILES Cn1c2nc(Br)n(CCCc3ccccc3)c2c(=O)[nH]c1=O Show InChI InChI=1S/C15H15BrN4O2/c1-19-12-11(13(21)18-15(19)22)20(14(16)17-12)9-5-8-10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3,(H,18,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	4.65E+4	n/a	n/a	n/a	n/a
PCMD Curated by PubChem BioAssay					Assay Description Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Brent Stockwell, Columbia University ML...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q21J984Z
					More data for this Ligand-Target Pair