Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.71 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.68 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.68 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.68 |
| ▸ | KLKB1 | P03952 | 3/20 | 0.64 |
| ▸ | HPGD | P15428 | 1/20 | 0.64 |
| ▸ | CA2 | P00918 | 1/20 | 0.63 |
| ▸ | F2 | P00734 | 3/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | RAB9A | P51151 | 1/20 | 0.62 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.61 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.59 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.59 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.59 |
| ▸ | PRKCG | P05129 | 1/20 | 0.59 |
| ▸ | PRKACA | P17612 | 1/20 | 0.59 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | AKT1 | P31749 | 1/20 | 0.59 |
| ▸ | GSK3A | P49840 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL11900090 | 0.88 | HDAC6 (0.85) | HDAC6HDAC2HDAC8HPGDCA2 | |
| SCHEMBL6140514 | 0.86 | HDAC6 (0.72) | HDAC6HDAC2HDAC8HPGDCA2 | |
| SCHEMBL457082 | 0.84 | HDAC6 (0.79) | HDAC6HDAC2HDAC8HPGDCA2 | |
| SCHEMBL9335737 | 0.83 | TPSAB1 (0.67) | TPSAB1HDAC6KLKB1CA2F2 | |
| SCHEMBL15606136 | 0.83 | EPHX2 (0.76) | TPSAB1HDAC6HDAC2HDAC8KLKB1 | |
| SCHEMBL6737728 | 0.83 | HDAC6 (0.72) | HDAC6HDAC2HDAC8HPGDCA2 | |
| SCHEMBL7983825 | 0.83 | TPSAB1 (0.59) | TPSAB1HDAC6KLKB1CA2F2 | |
| SCHEMBL4747957 | 0.82 | NR1H4 (0.81) | HDAC6HDAC2HDAC8HPGDCA2 | |
| SCHEMBL6843720 | 0.82 | HDAC6 (0.77) | HDAC6HDAC2HDAC8HPGDCA2 | |
| Hydrochloric Acid SCHEMBL3757721 | 0.82 | HDAC6 (0.76) | HDAC6HDAC2HDAC8HPGDCA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0730590-A1 | NOVEL ISOXAZOLINE AND ISOXAZOLE FIBRINOGEN RECEPTOR ANTAGONISTS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1996-09-11 | — | — | EP | disclosed |