Search and Browse
Download
Enter Data
| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | cGMP-dependent 3',5'-cyclic phosphodiesterase | ||
| Ligand | BDBM50263792 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1698247 (CHEMBL4049137) | ||
| IC50 | 1.0±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: |
| ||
| BDBM50263792 | |||
| n/a | |||
| Name | BDBM50263792 | ||
| Synonyms: | CHEMBL4091870 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C19H15F5N6O2 | ||
| Mol. Mass. | 454.3534 | ||
| SMILES | Cc1nn2c(nc(C(F)F)c2c(=O)[nH]1)-c1c(CO)nn(C)c1-c1ccc(cc1)C(F)(F)F |(18.22,-15.37,;19.54,-14.58,;20.88,-15.33,;22.2,-14.54,;23.68,-14.98,;24.56,-13.72,;23.64,-12.49,;24.09,-11.02,;23.1,-9.84,;25.61,-10.75,;22.18,-12.99,;20.84,-12.25,;20.81,-10.71,;19.52,-13.04,;24.18,-16.44,;25.66,-16.9,;26.89,-15.97,;26.7,-14.45,;25.68,-18.43,;24.22,-18.93,;23.77,-20.4,;23.3,-17.7,;21.76,-17.73,;21.01,-19.08,;19.47,-19.1,;18.68,-17.78,;19.43,-16.44,;20.96,-16.41,;17.13,-17.8,;16.73,-19.29,;15.65,-18.2,;16.34,-16.5,)| | ||
| Structure | 
| ||