BDBM50493161 CHEMBL2419550

SMILES: CN(C(=O)c1ccc(OCc2ccc3ccccc3n2)cc1)c1ccn2ncnc2c1

InChI Key: InChIKey=ICEIOKODQCTJDL-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 = 50493161   

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
3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50493161 (CHEMBL2419550) Show SMILES CN(C(=O)c1ccc(OCc2ccc3ccccc3n2)cc1)c1ccn2ncnc2c1 Show InChI InChI=1S/C24H19N5O2/c1-28(20-12-13-29-23(14-20)25-16-26-29)24(30)18-7-10-21(11-8-18)31-15-19-9-6-17-4-2-3-5-22(17)27-19/h2-14,16H,15H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
H. Lundbeck A/S Curated by ChEMBL					Assay Description Inhibition of PDE10A (unknown origin)				Bioorg Med Chem 21: 6053-62 (2013) Article DOI: 10.1016/j.bmc.2013.07.030 BindingDB Entry DOI: 10.7270/Q27P929Z
					More data for this Ligand-Target Pair