Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CTSC | P53634 | 1/20 | 0.35 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | FAAH | O00519 | 2/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.32 |
| ▸ | PLA2G2C | Q5R387 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2074129 | 0.79 | GPR84 (0.39) | CTSCFAAHFFAR4MAPTFFAR1 | |
| Hydrochloric Acid SCHEMBL11445364 | 0.78 | CTSS (0.43) | CTSCCTSSPLA2G2C | |
| SCHEMBL7998696 | 0.76 | CTSS (0.42) | CTSCHDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL2074212 | 0.73 | ALDH1A1 (0.40) | ALDH1A1HAO1HDAC3HDAC1HDAC2 | |
| SCHEMBL28481121 | 0.70 | HAO1 (0.39) | ALDH1A1HAO1KMT2AFAAHFFAR4 | |
| SCHEMBL13232045 | 0.69 | TDP1 (0.56) | ALDH1A1HAO1KMT2AFFAR4MAPT | |
| SCHEMBL1707003 | 0.69 | TDP1 (0.56) | ALDH1A1HAO1KMT2AFFAR4MAPT | |
| SCHEMBL11000950 | 0.69 | TDP1 (0.56) | ALDH1A1HAO1KMT2AFFAR4MAPT | |
| SCHEMBL17776278 | 0.69 | TDP1 (0.56) | ALDH1A1HAO1KMT2AFFAR4MAPT | |
| SCHEMBL12299385 | 0.69 | TDP1 (0.56) | ALDH1A1HAO1KMT2AFFAR4MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-7863294-B2 | Heterocycle derivatives as histone deacetylase (HDAC) inhibitors | INSTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2011-01-04 | — | — | US | disclosed |