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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cGMP-specific 3',5'-cyclic phosphodiesterase' and Ligand = 'BDBM50027734'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM50027734
PNG
(CHEMBL246136)
Show SMILES CCCc1nn(C)c2c1nc([nH]c2=O)-c1cc(ccc1OCC)S(=O)(=O)N1CCC(CC(O)=O)CC1
Show InChI InChI=1S/C24H31N5O6S/c1-4-6-18-21-22(28(3)27-18)24(32)26-23(25-21)17-14-16(7-8-19(17)35-5-2)36(33,34)29-11-9-15(10-12-29)13-20(30)31/h7-8,14-15H,4-6,9-13H2,1-3H3,(H,30,31)(H,25,26,32)
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Similars

Article
PubMed
n/an/a 0.331n/an/an/an/an/an/a



Sungkyunkwan University

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 17: 4271-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.064
BindingDB Entry DOI: 10.7270/Q289172C
More data for this
Ligand-Target Pair