BDBM50229798 CHEMBL314949

SMILES: Oc1nc2cc3cc(OCCCC(=O)N4CCN(Cc5cccc(c5)C(F)(F)F)CC4)ccc3[nH]c2n1

InChI Key: InChIKey=IUOKTQDAIMWTMR-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 = 50229798   

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 3 (Homo sapiens (Human))	BDBM50229798 (CHEMBL314949) Show SMILES Oc1nc2cc3cc(OCCCC(=O)N4CCN(Cc5cccc(c5)C(F)(F)F)CC4)ccc3[nH]c2n1 Show InChI InChI=1S/C26H26F3N5O3/c27-26(28,29)19-4-1-3-17(13-19)16-33-8-10-34(11-9-33)23(35)5-2-12-37-20-6-7-21-18(14-20)15-22-24(30-21)32-25(36)31-22/h1,3-4,6-7,13-15H,2,5,8-12,16H2,(H2,30,31,32,36)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of human platelet c-AMP phosphodiesterase PDE 3				J Med Chem 35: 2688-96 (1992) BindingDB Entry DOI: 10.7270/Q2PN97WB
					More data for this Ligand-Target Pair