Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.51 |
| ▸ | RELA | Q04206 | 1/20 | 0.51 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 17/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 17/20 | 0.50 |
| ▸ | HDAC11 | Q96DB2 | 17/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 17/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 17/20 | 0.50 |
| ▸ | HDAC5 | Q9UQL6 | 17/20 | 0.50 |
| ▸ | HDAC7 | Q8WUI4 | 16/20 | 0.50 |
| ▸ | HDAC9 | Q9UKV0 | 16/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 16/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8585476 | 0.83 | HDAC4 (0.70) | HDAC4HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL7109424 | 0.80 | ALDH1A1 (0.59) | ALDH1A1NPC1MAPTALOX15NFKB1 | |
| SCHEMBL8587363 | 0.79 | HDAC1 (0.75) | ALDH1A1NPC1RAB9ASMN1; SMN2HDAC4 | |
| SCHEMBL10281559 | 0.79 | HDAC6 (0.56) | HDAC4HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL23054823 | 0.78 | HDAC8 (0.66) | HDAC4HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL23054864 | 0.78 | HDAC8 (0.66) | HDAC4HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL23055025 | 0.78 | HDAC8 (0.66) | HDAC4HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL27574174 | 0.78 | LMNA (0.47) | ALDH1A1HDAC4HDAC1HDAC11HDAC8 | |
| SCHEMBL23054822 | 0.78 | HDAC8 (0.66) | HDAC4HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL8010609 | 0.77 | ALOX5 (0.60) | ALDH1A1NPC1MAPTALOX15NFKB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998031689-A1 | NOVEL MIXED BENZENE ACID DERIVATIVES, METHOD FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | ADIR ET COMPAGNIE (FR) | 1998-07-23 | — | — | WO | disclosed |