Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP2 | O95551 | 2/20 | 0.75 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.58 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.58 |
| ▸ | GRIA1 | P42261 | 2/20 | 0.54 |
| ▸ | CACNG8 | Q8WXS5 | 2/20 | 0.54 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | BRD4 | O60885 | 2/20 | 0.46 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.45 |
| ▸ | SRC | P12931 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10711490 | 0.90 | TDP2 (0.75) | TDP2PDE3BPDE3AMAOAMAOB | |
| SCHEMBL18010814 | 0.86 | TDP2 (1.00) | TDP2PDE3BPDE3A | |
| SCHEMBL155069 | 0.84 | PDE3B (0.62) | TDP2PDE3BPDE3AGRIA1CACNG8 | |
| SCHEMBL20214 | 0.83 | PDE3B (0.66) | TDP2PDE3BPDE3AGRIA1CACNG8 | |
| SCHEMBL31040124 | 0.83 | PDE3B (0.66) | TDP2PDE3BPDE3AGRIA1CACNG8 | |
| SCHEMBL4479338 | 0.79 | TDP2 (0.64) | TDP2PDE3BPDE3ABRD4CREBBP | |
| SCHEMBL3285782 | 0.78 | NPC1 (0.59) | PDE3BPDE3AGRIA1CACNG8MAOA | |
| SCHEMBL2170525 | 0.74 | GRIA1 (0.49) | TDP2PDE3BPDE3AGRIA1CACNG8 | |
| SCHEMBL10713385 | 0.74 | PDE3B (0.55) | TDP2PDE3BPDE3AMAOAMAOB | |
| SCHEMBL1875842 | 0.74 | CYP11B1 (0.79) | PDE3BPDE3AGRIA1CACNG8PGR |
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-2011056985-A2 | SUBSTITUTED HETEROCYCLIC COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2011-05-12 | — | — | WO | disclosed |