BDBM50493169 CHEMBL2419547

SMILES: CN(C(=O)c1ccc2ncsc2c1)c1ccc(OCc2nc3ccccc3o2)cc1

InChI Key: InChIKey=YQZSXWWORVKWPF-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 = 50493169   

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))	BDBM50493169 (CHEMBL2419547) Show SMILES CN(C(=O)c1ccc2ncsc2c1)c1ccc(OCc2nc3ccccc3o2)cc1 Show InChI InChI=1S/C23H17N3O3S/c1-26(23(27)15-6-11-19-21(12-15)30-14-24-19)16-7-9-17(10-8-16)28-13-22-25-18-4-2-3-5-20(18)29-22/h2-12,14H,13H2,1H3	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	920	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