Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 3/20 | 0.42 |
| ▸ | CES2 | O00748 | 2/20 | 0.42 |
| ▸ | DGKA | P23743 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | PAM | P19021 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1003368 | 0.82 | CES1 (0.46) | ALDH1A1TP53CES1CES2DGKA | |
| SCHEMBL10408354 | 0.80 | CES1 (0.44) | ALDH1A1TP53CES1CES2DGKA | |
| Hydrochloric Acid SCHEMBL27410812 | 0.80 | CES1 (0.44) | ALDH1A1TP53CES1CES2DGKA | |
| SCHEMBL11285973 | 0.79 | CES1 (0.48) | ALDH1A1TP53CES1CES2DGKA | |
| SCHEMBL6313766 | 0.79 | ALDH1A1 (0.46) | ALDH1A1TP53CES1CES2DGKA | |
| SCHEMBL9095803 | 0.79 | ALDH1A1 (0.41) | ALDH1A1TP53CES1CES2DGKA | |
| SCHEMBL7155025 | 0.78 | DGKA (0.52) | ALDH1A1CES1CES2DGKALMNA | |
| SCHEMBL28837891 | 0.78 | DGKA (0.52) | ALDH1A1CES1CES2DGKALMNA | |
| SCHEMBL10454783 | 0.78 | CES1 (0.42) | ALDH1A1TP53CES1CES2DGKA | |
| SCHEMBL11509336 | 0.78 | CES1 (0.42) | ALDH1A1TP53CES1CES2DGKA |
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-6201021-B1 | TREATMENT OF DISEASES INDUCED BY REACTIVE ASTROCYTES | ONO PHARMACEUTICAL CO., LTD. (JP) | 2001-03-13 | — | — | US | claimed |