Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 8/20 | 0.67 |
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.67 |
| ▸ | HDAC4 | P56524 | 7/20 | 0.67 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.67 |
| ▸ | RAB9A | P51151 | 8/20 | 0.64 |
| ▸ | NPC1 | O15118 | 7/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.64 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6462246 | 0.81 | RAB9A (0.66) | RAB9ANPC1SMN1; SMN2HPGDTAAR1 | |
| SCHEMBL4774806 | 0.80 | HDAC1 (1.00) | HDAC1HDAC6HDAC4HDAC3RAB9A | |
| SCHEMBL1868618 | 0.78 | NPC1 (0.60) | RAB9ANPC1SMN1; SMN2TAAR1LMNA | |
| SCHEMBL4767602 | 0.76 | HDAC1 (0.78) | HDAC1HDAC6HDAC4HDAC3RAB9A | |
| SCHEMBL10441735 | 0.76 | NPC1 (0.72) | RAB9ANPC1SMN1; SMN2HPGDTAAR1 | |
| SCHEMBL2201378 | 0.74 | HDAC1 (0.68) | HDAC1HDAC6HDAC4HDAC3RAB9A | |
| SCHEMBL2203043 | 0.74 | HDAC1 (0.66) | HDAC1HDAC6HDAC4HDAC3RAB9A | |
| SCHEMBL2228785 | 0.74 | HDAC1 (0.73) | HDAC1HDAC6HDAC4HDAC3RAB9A | |
| SCHEMBL1594597 | 0.73 | ALDH1A1 (0.54) | HDAC1HDAC6HDAC4HDAC3RAB9A | |
| SCHEMBL2203343 | 0.73 | HDAC1 (0.80) | HDAC1HDAC6HDAC4HDAC3RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1926721-A2 | THIOPHENE AND THIAZOLE SUBSTITUTED TRIFLUOROETHANONE DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS | Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) | 2008-06-04 | — | — | EP | disclosed |
| WO-2007029035-A2 | THIOPHENE AND THIAZOLE SUBSTITUTED TRIFLUOROETHANONE DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2007-03-15 | — | — | WO | disclosed |