Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKLR | P30613 | 15/20 | 0.61 |
| ▸ | CYP46A1 | Q9Y6A2 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16084357 | 0.78 | PKLR (0.60) | PKLRCYP46A1CYP3A4CYP2C8CYP2C9 | |
| SCHEMBL21976451 | 0.77 | PKLR (0.70) | PKLR | |
| SCHEMBL16049701 | 0.77 | AVPR1A (0.58) | PKLRCYP46A1CYP3A4CYP2C8CYP2C9 | |
| SCHEMBL16049630 | 0.77 | PKLR (1.00) | PKLR | |
| SCHEMBL2770336 | 0.76 | PKLR (0.51) | PKLRCYP46A1CYP3A4CYP2C8CYP2C9 | |
| SCHEMBL11255386 | 0.74 | RIPK1 (0.61) | PKLR | |
| SCHEMBL21977074 | 0.73 | PKLR (0.54) | PKLRCYP46A1CYP3A4CYP2C8CYP2C9 | |
| SCHEMBL14320380 | 0.72 | GRM3 (0.58) | PKLRCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL21976457 | 0.71 | ALDH1A1 (0.45) | PKLRCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL28023218 | 0.71 | PKLR (0.58) | 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 |