Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.68 |
| ▸ | PDE4A | P27815 | 3/20 | 0.66 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.66 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.66 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.66 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | CFTR | P13569 | 6/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.53 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7369620 | 0.90 | PDE4A (0.61) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7361489 | 0.87 | PDE4D (0.74) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7363642 | 0.87 | PDE4A (0.87) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7368621 | 0.82 | ALDH1A1 (1.00) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7363261 | 0.82 | ALDH1A1 (0.77) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL24000529 | 0.81 | ALDH1A1 (0.75) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL22721890 | 0.81 | ALDH1A1 (0.75) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL29539593 | 0.81 | ALDH1A1 (0.75) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7364068 | 0.80 | PDE4A (0.85) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| Pyridopyridazinone SCHEMBL6637552 | 0.80 | PDE4A (1.00) | ALDH1A1PDE4APDE4BPDE4CPDE4D |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5716954-A | ANTIINFLAMMATORY AGENT, ANTIHISTAMINES, IMMUNOSUPPRESSION,AUTOIMMUNE DISEASES | SYNTEX U.S.A. INC. (US) | 1998-02-10 | — | — | US | disclosed |
| 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 |