Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.45 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.45 |
| ▸ | PDE4A | P27815 | 3/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7369760 | 0.93 | PDE4A (0.51) | ALDH1A1CYP1A2CYP3A4NPSR1CYP2C9 | |
| SCHEMBL7365955 | 0.92 | PDE4A (0.52) | ALDH1A1CYP1A2CYP3A4NPSR1CYP2C9 | |
| SCHEMBL7365466 | 0.88 | ALDH1A1 (0.56) | ALDH1A1CYP1A2CYP3A4NPSR1CYP2C9 | |
| SCHEMBL7367402 | 0.87 | NCOA1 (0.46) | ALDH1A1HTTHPGDMEN1KMT2A | |
| SCHEMBL7362202 | 0.86 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP3A4NPSR1CYP2C9 | |
| SCHEMBL7367645 | 0.86 | F2RL3 (0.55) | ALDH1A1CYP1A2CYP3A4NPSR1CYP2C9 | |
| SCHEMBL7364996 | 0.85 | PDE4A (0.61) | ALDH1A1CYP1A2CYP3A4NPSR1CYP2C9 | |
| SCHEMBL7369761 | 0.84 | ALDH1A1 (0.70) | ALDH1A1CYP1A2CYP3A4NPSR1CYP2C9 | |
| SCHEMBL7366591 | 0.84 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP3A4NPSR1CYP2C9 | |
| SCHEMBL7367503 | 0.83 | HPGD (0.48) | ALDH1A1CYP1A2CYP3A4NPSR1CYP2C9 |
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-0612321-A1 | PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY | SYNTEX (U.S.A.) INC. (US) | 1994-08-31 | — | — | EP | disclosed |
| WO-1993007146-A1 | BENZO AND PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY | SYNTEX (U.S.A.) INC. (US) | 1993-04-15 | — | — | WO | disclosed |