Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPB1 | P04792 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23440639 | 1.00 | HSPB1 (0.48) | HSPB1CA1CA2CES2CES1 | |
| SCHEMBL15635076 | 0.94 | CA1 (0.53) | CA1CA2CES2CES1MAPT | |
| SCHEMBL15536414 | 0.91 | ALDH1A1 (0.50) | CA1CA2CES2CES1MAPT | |
| SCHEMBL17760460 | 0.91 | ALDH1A1 (0.50) | CA1CA2CES2CES1MAPT | |
| SCHEMBL14989437 | 0.91 | ALDH1A1 (0.50) | CA1CA2CES2CES1MAPT | |
| SCHEMBL15536216 | 0.91 | ALDH1A1 (0.50) | CA1CA2CES2CES1MAPT | |
| SCHEMBL23803197 | 0.91 | ALDH1A1 (0.50) | CA1CA2CES2CES1MAPT | |
| SCHEMBL23803196 | 0.91 | ALDH1A1 (0.50) | CA1CA2CES2CES1MAPT | |
| SCHEMBL17712319 | 0.91 | ALDH1A1 (0.50) | CA1CA2CES2CES1MAPT | |
| SCHEMBL27144626 | 0.90 | MEN1 (0.45) | CA1CA2CES2CES1MAPT |
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-3831388-A1 | CYCLOPENTENYL PURINE DERIVATIVE OR SALT THEREOF | FUJIFILM Corporation (JP) | 2021-06-09 | — | — | EP | disclosed |