Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cGMP-specific 3',5'-cyclic phosphodiesterase' and Ligand = 'BDBM258419'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM258419 (US9505786, 7-2) Show SMILES CC[C@]1(C)C(=O)Nc2nc(nnc12)-c1nn(Cc2ccccc2F)c2ncc(F)cc12 |r| Show InChI InChI=1S/C21H17F2N7O/c1-3-21(2)16-18(26-20(21)31)25-17(28-27-16)15-13-8-12(22)9-24-19(13)30(29-15)10-11-6-4-5-7-14(11)23/h4-9H,3,10H2,1-2H3,(H,25,26,28,31)/t21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	350	n/a	n/a	n/a	n/a	7.5	25
BAYER PHARMA AKTIENGESELLSCHAFT; BAYER INTELLECTUAL PROPERTY GMBH US Patent					Assay Description To determine their in vitro action on human PDE 5, the test substances are dissolved in 100% DMSO and serially diluted. Typically, dilution series (1...				US Patent US9505786 (2016) BindingDB Entry DOI: 10.7270/Q2WS8S6V
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