Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKLR | P30613 | 14/20 | 0.49 |
| ▸ | AVPR1A | P37288 | 3/20 | 0.41 |
| ▸ | TYK2 | P29597 | 1/20 | 0.40 |
| ▸ | CYP46A1 | Q9Y6A2 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16051036 | 0.82 | PKLR (0.59) | PKLR | |
| SCHEMBL21976822 | 0.73 | PKLR (0.60) | PKLRAVPR1ACYP46A1CYP3A4CYP2C19 | |
| SCHEMBL21975989 | 0.73 | PKLR (0.66) | PKLRCYP46A1CYP3A4CYP2C8CYP2C9 | |
| SCHEMBL16083849 | 0.70 | PKLR (0.59) | PKLRAVPR1ATYK2CYP46A1 | |
| SCHEMBL16130135 | 0.69 | PKLR (0.64) | PKLRAVPR1ATYK2CYP46A1 | |
| SCHEMBL16049701 | 0.68 | AVPR1A (0.58) | PKLRAVPR1ACYP46A1CYP3A4CYP2C8 | |
| SCHEMBL21976020 | 0.67 | PKLR (0.51) | PKLRAVPR1ATYK2 | |
| SCHEMBL16049804 | 0.67 | PKLR (0.65) | PKLR | |
| SCHEMBL21977074 | 0.67 | PKLR (0.54) | PKLRAVPR1ACYP46A1CYP3A4CYP2C8 | |
| SCHEMBL21976261 | 0.66 | PKLR (0.57) | PKLR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2970189-B1 | THERAPEUTIC COMPOUNDS AND COMPOSITIONS | AGIOS PHARMACEUTICALS INC (US) | 2020-05-06 | — | — | EP | disclosed |