Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARD | Q03181 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3313657 | 0.83 | PPARD (0.70) | PPARDTSHRTP53TDP1MEN1 | |
| SCHEMBL5017294 | 0.78 | PPARD (0.64) | PPARDTSHRTP53TDP1 | |
| SCHEMBL7268189 | 0.78 | PPARD (0.64) | PPARDTSHRTP53TDP1 | |
| SCHEMBL248038 | 0.78 | PPARD (0.64) | PPARDTSHRTP53TDP1 | |
| SCHEMBL7044718 | 0.78 | TSHR (0.60) | PPARDTSHRTP53TDP1MEN1 | |
| SCHEMBL11514496 | 0.76 | PPARD (0.61) | PPARDTSHRTP53TDP1 | |
| SCHEMBL7268183 | 0.76 | PPARD (0.61) | PPARDTSHRTP53TDP1 | |
| SCHEMBL11323349 | 0.76 | PPARD (0.61) | PPARDTSHRTP53TDP1 | |
| SCHEMBL11127676 | 0.74 | PPARD (0.58) | PPARDTSHRTP53TDP1MEN1 | |
| SCHEMBL331812 | 0.74 | PPARD (0.58) | PPARDTSHRTP53TDP1MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1620445-A2 | METHOD AND COMPOSITIONS FOR IDENTIFYING ANTI-HIV THERAPEUTIC COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2006-02-01 | — | — | EP | disclosed |
| WO-2004096818-A2 | METHOD AND COMPOSITIONS FOR IDENTIFYING ANTI-HIV THERAPEUTIC COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2004-11-11 | — | — | WO | disclosed |