Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.75 |
| ▸ | USP2 | O75604 | 1/20 | 0.64 |
| ▸ | MAPT | P10636 | 2/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.64 |
| ▸ | MEN1 | O00255 | 1/20 | 0.64 |
| ▸ | NPC1 | O15118 | 2/20 | 0.61 |
| ▸ | RAB9A | P51151 | 2/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.57 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL19427444 | 0.90 | ALDH1A1 (0.73) | ALDH1A1USP2MAPTKMT2AMEN1 | |
| SCHEMBL19427481 | 0.90 | KMT2A (0.68) | ALDH1A1MAPTKMT2AMEN1CYP1A2 | |
| SCHEMBL5164423 | 0.86 | ALDH1A1 (0.63) | ALDH1A1USP2MAPTKMT2AMEN1 | |
| SCHEMBL19427487 | 0.85 | MEN1 (0.62) | ALDH1A1MAPTKMT2AMEN1NPC1 | |
| Ammonia Solution, Strong SCHEMBL5307185 | 0.85 | ALDH1A1 (0.61) | ALDH1A1USP2MAPTKMT2AMEN1 | |
| SCHEMBL10852085 | 0.83 | ALDH1A1 (0.82) | ALDH1A1USP2MAPTKMT2ANPC1 | |
| SCHEMBL4362583 | 0.83 | MEN1 (0.64) | ALDH1A1KMT2AMEN1 | |
| SCHEMBL2092856 | 0.83 | ALDH1A1 (0.82) | ALDH1A1USP2MAPTKMT2ANPC1 | |
| SCHEMBL2092853 | 0.83 | ALDH1A1 (0.82) | ALDH1A1USP2MAPTKMT2ANPC1 | |
| SCHEMBL5164776 | 0.82 | ALDH1A1 (0.61) | ALDH1A1USP2MAPTKMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017168024-A1 | COMPOUNDS WITH ANTIOXIDANT ACTIVITY AND USES THEREOF | CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (CSIC) (ES) | 2017-10-05 | — | — | WO | disclosed |