Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 5/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 4/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10513244 | 1.00 | ALDH1A1 (0.39) | ALDH1A1TP53ATMTSHRHPGD | |
| SCHEMBL9730225 | 0.82 | ALDH1A1 (0.40) | ALDH1A1TP53ATMTSHRMAPK1 | |
| SCHEMBL9730046 | 0.82 | ALDH1A1 (0.40) | ALDH1A1TP53ATMTSHRMAPK1 | |
| SCHEMBL17030299 | 0.81 | ALDH1A1 (0.36) | ALDH1A1TP53ATMTSHRHPGD | |
| Hydrochloric Acid SCHEMBL10513248 | 0.80 | ALDH1A1 (0.39) | ALDH1A1TP53ATMTSHRMAPK1 | |
| SCHEMBL18265384 | 0.80 | ALDH1A1 (0.48) | ALDH1A1ATMTSHRHPGDLMNA | |
| Hydrochloric Acid SCHEMBL9730267 | 0.80 | ALDH1A1 (0.39) | ALDH1A1TP53ATMTSHRMAPK1 | |
| SCHEMBL9687270 | 0.79 | ALDH1A1 (0.41) | ALDH1A1TP53ATMTSHRHPGD | |
| SCHEMBL9730106 | 0.79 | LMNA (0.38) | ALDH1A1LMNA | |
| SCHEMBL27818476 | 0.75 | ALDH1A1 (0.41) | ALDH1A1TP53ATMTSHRHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-5167863-A | Ferroelectricity; electrooptic switches | HITACHI, LTD. (JP) | 1992-12-01 | — | — | US | disclosed |
| EP-0322862-A2 | Optically active compounds, their preparation and their use in liquid crystal compositions and liquid crystal optical modulators | HITACHI, LTD. (JP) | 1989-07-05 | — | — | EP | disclosed |