Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKLR | P30613 | 12/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL16084023 | 0.84 | PKLR (0.78) | PKLRALDH1A1GAA | |
| SCHEMBL16083997 | 0.75 | PKLR (0.77) | PKLR | |
| SCHEMBL15713675 | 0.74 | PKLR (0.63) | PKLRALDH1A1GAAKDM1A | |
| SCHEMBL16084068 | 0.71 | PKLR (1.00) | PKLRALDH1A1LMNAGAA | |
| SCHEMBL16130053 | 0.70 | PKLR (0.80) | PKLRALDH1A1LMNAGAA | |
| SCHEMBL16083871 | 0.69 | PKLR (0.82) | PKLRALDH1A1POLBGAA | |
| SCHEMBL16051153 | 0.68 | HTT (0.68) | PKLRNPC1RAB9AALDH1A1LMNA | |
| SCHEMBL16083860 | 0.67 | PKLR (0.82) | PKLRALDH1A1LMNAGAA | |
| SCHEMBL20764443 | 0.67 | KDM1A (0.68) | POLBGAAKDM1A | |
| SCHEMBL21976639 | 0.66 | PKLR (0.52) | PKLRALDH1A1LMNAKDM1A |
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 |