BDBM50163569 2-(5-Bromo-pyrimidin-2-yl)-3-(2,3-dihydro-benzofuran-5-yl)-1,2,3,4-tetrahydro-pyrrolo[3,4-b]quinolin-9-one::CHEMBL368283

SMILES: Oc1c2CN(C(c2nc2ccccc12)c1ccc2OCCc2c1)c1ncc(Br)cn1

InChI Key: InChIKey=HZZQRGYYLYWJER-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 50163569   

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
Phosphodiesterase 5A (Rattus norvegicus)	BDBM50163569 (2-(5-Bromo-pyrimidin-2-yl)-3-(2,3-dihydro-benzofur...) Show SMILES Oc1c2CN(C(c2nc2ccccc12)c1ccc2OCCc2c1)c1ncc(Br)cn1 Show InChI InChI=1S/C23H17BrN4O2/c24-15-10-25-23(26-11-15)28-12-17-20(27-18-4-2-1-3-16(18)22(17)29)21(28)14-5-6-19-13(9-14)7-8-30-19/h1-6,9-11,21H,7-8,12H2,(H,27,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson Pharmaceutical Research and Development Curated by ChEMBL					Assay Description Inhibitory concentration against phosphodiesterase 5 in rat fetal lung fibroblast (RFL-6) cells				J Med Chem 48: 2126-33 (2005) Article DOI: 10.1021/jm0401098 BindingDB Entry DOI: 10.7270/Q2WH2QR5
					More data for this Ligand-Target Pair