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Target
cGMP-dependent 3',5'-cyclic phosphodiesterase
Ligand
BDBM107843
Substrate
n/a
Meas. Tech.
Inhibition Assay
IC50
1.08±0.0 nM
Citation
 Helal, CJ; Chappie, TA; Humphrey, JM; Verhoest, PR; Yang, E Imidazo[5,1-f][1,2,4]triazines for the treatment of neurological disorders US Patent  US8598155 Publication Date 12/3/2013 
Target
Name:
cGMP-dependent 3',5'-cyclic phosphodiesterase
Synonyms:
CGS-PDE | Cyclic GMP-stimulated phosphodiesterase | Homo sapiens phosphodiesterase 2A (PDE2A) | NM_002599 | PDE2A | PDE2A_HUMAN | cGSPDE
Type:
Enzyme Catalytic Domain
Mol. Mass.:
105691.58
Organism:
Homo sapiens (Human)
Description:
O00408
Residue:
941
Sequence:
MGQACGHSILCRSQQYPAARPAEPRGQQVFLKPDEPPPPPQPCADSLQDALLSLGSVIDISGLQRAVKEALSAVLPRVETVYTYLLDGESQLVCEDPPHELPQEGKVREAIISQKRLGCNGLGFSDLPGKPLARLVAPLAPDTQVLVMPLADKEAGAVAAVILVHCGQLSDNEEWSLQAVEKHTLVALRRVQVLQQRGPREAPRAVQNPPEGTAEDQKGGAAYTDRDRKILQLCGELYDLDASSLQLKVLQYLQQETRASRCCLLLVSEDNLQLSCKVIGDKVLGEEVSFPLTGCLGQVVEDKKSIQLKDLTSEDVQQLQSMLGCELQAMLCVPVISRATDQVVALACAFNKLEGDLFTDEDEHVIQHCFHYTSTVLTSTLAFQKEQKLKCECQALLQVAKNLFTHLDDVSVLLQEIITEARNLSNAEICSVFLLDQNELVAKVFDGGVVDDESYEIRIPADQGIAGHVATTGQILNIPDAYAHPLFYRGVDDSTGFRTRNILCFPIKNENQEVIGVAELVNKINGPWFSKFDEDLATAFSIYCGISIAHSLLYKKVNEAQYRSHLANEMMMYHMKVSDDEYTKLLHDGIQPVAAIDSNFASFTYTPRSLPEDDTSMAILSMLQDMNFINNYKIDCPTLARFCLMVKKGYRDPPYHNWMHAFSVSHFCYLLYKNLELTNYLEDIEIFALFISCMCHDLDHRGTNNSFQVASKSVLAALYSSEGSVMERHHFAQAIAILNTHGCNIFDHFSRKDYQRMLDLMRDIILATDLAHHLRIFKDLQKMAEVGYDRNNKQHHRLLLCLLMTSCDLSDQTKGWKTTRKIAELIYKEFFSQGDLEKAMGNRPMEMMDREKAYIPELQISFMEHIAMPIYKLLQDLFPKAAELYERVASNREHWTKVSHKFTIRGLPSNNSLDFLDEEYEVPDLDGTRAPINGCCSLDAE
  
Inhibitor
Name:
BDBM107843
Synonyms:
US8598155, 81
Type:
Small organic molecule
Emp. Form.:
C20H16F5N7
Mol. Mass.:
449.38
SMILES:
Cc1nc(-c2cnn(C)c2-c2ccc(cc2F)C(F)(F)F)c2c(ncnn12)N1CC(F)C1 |(-1,-3.22,;-1.77,-1.88,;-.87,-.64,;-1.77,.61,;-1,1.94,;-1.91,3.19,;-1,4.43,;.46,3.96,;1.79,4.73,;.46,2.42,;1.55,1.33,;1.15,-.16,;2.24,-1.25,;3.73,-.85,;4.13,.64,;3.04,1.73,;3.44,3.22,;4.82,-1.94,;5.91,-3.03,;3.73,-3.03,;5.91,-.85,;-3.24,.13,;-4.57,.9,;-5.91,.13,;-5.91,-1.41,;-4.57,-2.18,;-3.24,-1.41,;-4.57,2.44,;-3.48,3.53,;-4.57,4.62,;-4.57,6.16,;-5.66,3.53,)|
Structure:
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