Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE1A | P54750 | 7/20 | 0.39 |
| ▸ | PDE1B | Q01064 | 7/20 | 0.39 |
| ▸ | PDE1C | Q14123 | 7/20 | 0.39 |
| ▸ | PDE2A | O00408 | 5/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | CFTR | P13569 | 2/20 | 0.39 |
| ▸ | PDE4A | P27815 | 2/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | SCN1A | P35498 | 1/20 | 0.39 |
| ▸ | PDE6C | P51160 | 1/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.39 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5647 | 0.77 | ADORA2A (0.43) | PDE1APDE1BPDE1CPDE2ATSHR | |
| SCHEMBL515776 | 0.76 | ALDH1A1 (0.54) | TSHRCYP3A4MAPK1ADORA1ADORA2A | |
| SCHEMBL9031171 | 0.74 | PDE4A (0.35) | TSHRPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL169145 | 0.73 | KDM4E (0.41) | PDE1APDE1BPDE1CPDE2ATSHR | |
| SCHEMBL27620150 | 0.73 | CYP3A4 (0.40) | TSHRPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL9885811 | 0.73 | KDM4E (0.48) | PDE1APDE1BPDE1CPDE2ATSHR | |
| SCHEMBL18991108 | 0.71 | HSP90B1 (0.46) | CYP3A4CYP1A2MAPK1LMNAMAPT | |
| SCHEMBL2462137 | 0.71 | PDE4A (0.69) | PDE1APDE1BPDE1CPDE4APDE4B | |
| SCHEMBL13111707 | 0.69 | PDE1A (0.49) | PDE1APDE1BPDE1CPDE2ATSHR | |
| SCHEMBL16359618 | 0.68 | ADORA2A (0.45) | PDE4APDE4BPDE4CPDE4DCYP1A2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1999026657-A1 | INHIBITORS OF NITRIC OXIDE SYNTHASE | MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) | 1999-06-03 | — | — | WO | disclosed |