Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | FFAR2 | O15552 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL13370728 | 0.77 | ALDH1A1 (0.41) | PKMALDH1A1HTTMAPTLMNA | |
| SCHEMBL27651626 | 0.75 | ALDH1A1 (0.41) | PKMALDH1A1HTTMAPTLMNA | |
| SCHEMBL1133747 | 0.74 | ALDH1A1 (0.40) | PKMALDH1A1HTTMAPTLMNA | |
| SCHEMBL27630399 | 0.74 | ALDH1A1 (0.40) | PKMALDH1A1HTTMAPTLMNA | |
| SCHEMBL7456124 | 0.72 | ALDH1A1 (0.51) | PKMALDH1A1HTTMAPTLMNA | |
| SCHEMBL8701139 | 0.72 | PKM (0.38) | PKMALDH1A1HTTMAPTLMNA | |
| SCHEMBL7405770 | 0.72 | HSD17B10 (0.40) | ALDH1A1HTTMAPTLMNASMN1; SMN2 | |
| SCHEMBL27641755 | 0.72 | ALDH1A1 (0.41) | PKMALDH1A1HTTMAPTLMNA | |
| SCHEMBL29053272 | 0.72 | ALDH1A1 (0.38) | PKMALDH1A1HTTMAPTLMNA | |
| SCHEMBL2041342 | 0.72 | PKM (0.42) | PKMALDH1A1HTTMAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-1387528-A | Heterocyclic substd, pyrazolones | CEPHALON INC (US) | 2002-12-25 | — | — | CN | disclosed |