BDBM50457396 CHEMBL4206492

SMILES: O=c1[nH]c(Cc2ccccn2)nc2n(ncc12)C1CCOCC1

InChI Key: InChIKey=BZTIJCSHNVZMES-UHFFFAOYSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50457396   

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))	BDBM50457396 (CHEMBL4206492) Show SMILES O=c1[nH]c(Cc2ccccn2)nc2n(ncc12)C1CCOCC1 Show InChI InChI=1S/C16H17N5O2/c22-16-13-10-18-21(12-4-7-23-8-5-12)15(13)19-14(20-16)9-11-3-1-2-6-17-11/h1-3,6,10,12H,4-5,7-9H2,(H,19,20,22)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	52	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of PDE9A (unknown origin)				J Med Chem 61: 5467-5483 (2018) Article DOI: 10.1021/acs.jmedchem.7b01370 BindingDB Entry DOI: 10.7270/Q22B91MK
					More data for this Ligand-Target Pair