Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 16/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL7032727 | 1.00 | HDAC8 (0.50) | HDAC8ALDH1A1HDAC1HDAC3HDAC2 | |
| SCHEMBL7032203 | 0.88 | HDAC8 (0.63) | HDAC8HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL7032205 | 0.88 | HDAC8 (0.63) | HDAC8HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL29398382 | 0.81 | CYP2C9 (0.51) | HDAC8ALDH1A1HDAC1HDAC3HDAC2 | |
| SCHEMBL21690291 | 0.81 | CYP2C9 (0.51) | HDAC8ALDH1A1HDAC1HDAC3HDAC2 | |
| SCHEMBL29398451 | 0.81 | CYP2C9 (0.51) | HDAC8ALDH1A1HDAC1HDAC3HDAC2 | |
| Hydrochloric Acid SCHEMBL27557729 | 0.81 | HDAC8 (0.46) | HDAC8ALDH1A1HDAC1HDAC3HDAC2 | |
| SCHEMBL7033985 | 0.78 | CTSC (0.52) | — | |
| SCHEMBL7033988 | 0.78 | CTSC (0.52) | — | |
| Hydrochloric Acid SCHEMBL27578024 | 0.77 | CYP3A4 (0.45) | HDAC8ALDH1A1HDAC1HDAC3HDAC2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0977730-B1 | AMINO ACID DERIVATIVES INHIBITING EXTRACELLULAR MATRIX METALLOPROTEINASE AND TNF ALPHA RELEASE | CHIESI FARMA SPA (IT) | 2003-03-12 | — | — | EP | disclosed |
| EP-0977730-A1 | AMINO ACID DERIVATIVES INHIBITING EXTRACELLULAR MATRIX METALLOPROTEINASE AND TNF ALPHA RELEASE | CHIESI FARMACEUTICI S.p.A. (IT) | 2000-02-09 | — | — | EP | disclosed |
| WO-1998047863-A1 | AMINO ACID DERIVATIVES INHIBITING EXTRACELLULAR MATRIX METALLOPROTEINASE AND TNF ALPHA RELEASE | CHIESI FARMACEUTICI S.P.A. (IT) | 1998-10-29 | — | — | WO | disclosed |