Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNE2 | O96020 | 2/20 | 0.44 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.44 |
| ▸ | CDK2 | P24941 | 2/20 | 0.44 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | GPR55 | Q9Y2T6 | 2/20 | 0.39 |
| ▸ | GYS1 | P13807 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8629112 | 0.88 | PTGS1 (0.44) | LRRK2PTGS2PTGS1MEN1CYP1A2 | |
| SCHEMBL8633967 | 0.84 | LRRK2 (0.58) | LRRK2PTGS2PTGS1MEN1CYP1A2 | |
| SCHEMBL8627791 | 0.83 | PTGS1 (0.42) | LRRK2PTGS2PTGS1MEN1CYP1A2 | |
| SCHEMBL8632292 | 0.81 | PTGS2 (0.41) | LRRK2PTGS2PTGS1MEN1CYP1A2 | |
| SCHEMBL7779803 | 0.81 | PTGS2 (0.50) | LRRK2PTGS2PTGS1CA12CA1 | |
| SCHEMBL8632688 | 0.79 | GYS1 (0.58) | LRRK2PTGS2PTGS1MEN1MAPT | |
| SCHEMBL8635076 | 0.79 | PTGS2 (0.41) | LRRK2PTGS2PTGS1MEN1CYP1A2 | |
| SCHEMBL8631595 | 0.78 | GYS1 (0.48) | LRRK2PTGS2PTGS1MEN1MAPT | |
| SCHEMBL8635017 | 0.77 | GYS1 (0.47) | LRRK2PTGS2PTGS1MEN1MAPT | |
| SCHEMBL7777645 | 0.74 | PTGS2 (0.54) | PTGS2PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5756530-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS | G. D. SEARLE & CO. (US) | 1998-05-26 | — | — | US | disclosed |