Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F3 | P13726 | 3/20 | 0.58 |
| ▸ | GSK3B | P49841 | 2/20 | 0.56 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.54 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.54 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.54 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.54 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.54 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | MAOB | P27338 | 4/20 | 0.53 |
| ▸ | MAOA | P21397 | 3/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL2455416 | 0.93 | F3 (0.51) | F3GSK3BHDAC3HDAC4HDAC1 | |
| SCHEMBL28637442 | 0.92 | BCHE (0.61) | F3GSK3BMAPTALDH1A1CYP3A4 | |
| SCHEMBL8648429 | 0.84 | GSK3B (0.61) | F3GSK3BHDAC3HDAC4HDAC1 | |
| SCHEMBL12480336 | 0.83 | F3 (0.62) | F3GSK3BHDAC3HDAC4HDAC1 | |
| SCHEMBL2998855 | 0.83 | PAM (0.61) | F3GSK3BHDAC3HDAC1HDAC2 | |
| SCHEMBL2998851 | 0.83 | PAM (0.61) | F3GSK3BHDAC3HDAC1HDAC2 | |
| SCHEMBL9717512 | 0.81 | MAPT (0.55) | GSK3BMAPTALDH1A1CYP3A4ATM | |
| SCHEMBL1186667 | 0.79 | HDAC3 (0.61) | GSK3BHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL31119870 | 0.79 | HDAC3 (0.61) | GSK3BHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL8726134 | 0.79 | F3 (0.53) | F3MAPTALDH1A1CYP3A4MAOB |
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 |
|---|---|---|---|---|---|---|---|
| US-5162285-A | Carbonylation of Rhodium Salts, Reaction with Ozone or Oxygen | PRINCETON UNIVERSITY (US) | 1992-11-10 | — | — | US | disclosed |
| US-5126490-A | Rhodium carbonyl catalyst | PRINCETON UNIVERSITY (US) | 1992-06-30 | — | — | US | disclosed |