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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | cGMP-dependent 3',5'-cyclic phosphodiesterase | ||
| Ligand | BDBM50263780 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1698247 (CHEMBL4049137) | ||
| IC50 | 17±n/a nM | ||
| Citation |  Obach, RS; Walker, GS; Sharma, R; Jenkinson, S; Tran, TP; Stepan, AF Lead Diversification at the Nanomole Scale Using Liver Microsomes and Quantitative Nuclear Magnetic Resonance Spectroscopy: Application to Phosphodiesterase 2 Inhibitors. J Med Chem61:3626-3640 (2018) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| cGMP-dependent 3',5'-cyclic phosphodiesterase | |||
| 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: |
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| BDBM50263780 | |||
| n/a | |||
| Name | BDBM50263780 | ||
| Synonyms: | CHEMBL4093549 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C18H16F3N7O2 | ||
| Mol. Mass. | 419.3605 | ||
| SMILES | Cc1nn(C)c(c1-c1nc(CO)c2n1nc(C)[nH]c2=O)-c1ccc(cn1)C(F)(F)F |(26.28,-13.87,;25.04,-14.78,;25.04,-16.32,;23.57,-16.79,;23.1,-18.25,;22.67,-15.54,;23.58,-14.3,;23.1,-12.83,;24.01,-11.59,;23.11,-10.34,;23.59,-8.88,;22.57,-7.73,;21.64,-10.82,;21.64,-12.36,;20.31,-13.12,;18.98,-12.35,;17.65,-13.12,;18.98,-10.81,;20.31,-10.05,;20.31,-8.51,;21.13,-15.54,;20.36,-16.87,;18.82,-16.87,;18.06,-15.53,;18.83,-14.2,;20.37,-14.2,;16.51,-15.53,;16.51,-17.07,;15.18,-16.29,;15.75,-14.19,)| | ||
| Structure | 
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