Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9732612 | 1.00 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2NPSR1L3MBTL1CYP1A2 | |
| SCHEMBL9732749 | 0.87 | MAPT (0.55) | ALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL9732692 | 0.84 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2NPSR1CYP1A2CYP2C9 | |
| SCHEMBL9384516 | 0.83 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2NPSR1L3MBTL1CYP1A2 | |
| SCHEMBL9767528 | 0.83 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2NPSR1L3MBTL1CYP1A2 | |
| SCHEMBL9767524 | 0.83 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2NPSR1L3MBTL1CYP1A2 | |
| SCHEMBL9384512 | 0.83 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2NPSR1L3MBTL1CYP1A2 | |
| SCHEMBL30615664 | 0.83 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2NPSR1L3MBTL1CYP1A2 | |
| SCHEMBL9733170 | 0.81 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2NPSR1L3MBTL1CYP1A2 | |
| SCHEMBL9733174 | 0.81 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2NPSR1L3MBTL1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992013846-A1 | PYRIMIDINYL- AND TRIAZINYLSALICYL- AND -PICOLINYLALDEHYDE DERIVATIVES | CIBA-GEIGY AG (CH) | 1992-08-20 | — | — | WO | claimed |
| WO-1992013846-A1 | PYRIMIDINYL- AND TRIAZINYLSALICYL- AND -PICOLINYLALDEHYDE DERIVATIVES | CIBA-GEIGY AG (CH) | 1992-08-20 | — | — | WO | disclosed |