Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | LCK | P06239 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.32 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.32 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5148472 | 0.84 | ALDH1A1 (0.37) | ALDH1A1CA2ATMCES2TSHR | |
| SCHEMBL1077670 | 0.81 | ALDH1A1 (0.41) | ALDH1A1CA2MAPK1ATMHCAR2 | |
| SCHEMBL21544059 | 0.80 | ALDH1A1 (0.39) | ALDH1A1CA2MAPK1ATMHCAR2 | |
| SCHEMBL2671988 | 0.80 | ALDH1A1 (0.39) | ALDH1A1CA2MAPK1ATMHCAR2 | |
| Acetone SCHEMBL27701709 | 0.80 | ALDH1A1 (0.54) | ALDH1A1ATMHCAR2CES2HPGD | |
| SCHEMBL10791440 | 0.79 | ALDH1A1 (0.38) | ALDH1A1CA2MAPK1ATMHCAR2 | |
| SCHEMBL6281801 | 0.77 | ALDH1A1 (0.37) | ALDH1A1CA2MAPK1ATMHCAR2 | |
| SCHEMBL157028 | 0.77 | — | — | |
| SCHEMBL21219177 | 0.75 | TDP1 (0.38) | ALDH1A1CA2MAPK1GPR84LCK | |
| SCHEMBL21519882 | 0.75 | TDP1 (0.38) | ALDH1A1CA2MAPK1GPR84LCK |
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-4424091-A | METAL COMPOUND | DAI NIPPON INSATSU KABUSHIKI KAISHA (JP) | 1984-01-03 | — | — | US | disclosed |
| US-4271224-A | A METAL COMPOUND CAUSES THE COLORING AGENT TO LOSE ITS HEAT TRANSFERIBILITY | DAI NIPPON INSATSU KABUSHIKI KAISHA (JP) | 1981-06-02 | — | — | US | disclosed |