Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 8/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 2/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8767485 | 0.77 | ALDH1A1 (0.56) | GSK3BALDH1A1SMN1; SMN2TP53NPC1 | |
| SCHEMBL4850527 | 0.77 | GSK3B (0.51) | GSK3BALDH1A1SMN1; SMN2TP53NPC1 | |
| SCHEMBL4493177 | 0.76 | BACE1 (0.63) | GSK3BALDH1A1SMN1; SMN2TP53NPC1 | |
| SCHEMBL259076 | 0.73 | PDE10A (0.52) | — | |
| SCHEMBL11502325 | 0.73 | ADORA1 (0.56) | GSK3BALDH1A1SMN1; SMN2TP53NPC1 | |
| SCHEMBL8901945 | 0.73 | SMN1; SMN2 (0.42) | ALDH1A1SMN1; SMN2POLBKDM4E | |
| Hydrochloric Acid SCHEMBL16972416 | 0.72 | PDE10A (0.51) | — | |
| SCHEMBL10490494 | 0.72 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2BACE1POLBKDM4E | |
| SCHEMBL7385338 | 0.71 | GSK3B (0.59) | GSK3BALDH1A1MEN1KMT2ACYP1A2 | |
| SCHEMBL4859153 | 0.71 | GSK3B (0.51) | GSK3BALDH1A1SMN1; SMN2TP53NPC1 |
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-0724573-A1 | PYRIMIDINONES AS ANTIARTHRITIC AND ANTI-INFLAMMATORIES | PHARMACIA & UPJOHN COMPANY (US) | 1996-08-07 | — | — | EP | disclosed |
| WO-1995011235-A1 | PYRIMIDINONES AS ANTIARTHRITIC AND ANTI-INFLAMMATORIES | THE UPJOHN COMPANY (US) | 1995-04-27 | — | — | WO | disclosed |