Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HBB | P68871 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | STAT3 | P40763 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | APAF1 | O14727 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10404626 | 0.90 | ALDH1A1 (0.44) | ALDH1A1IDO1CYP1A2CYP3A4MAPK1 | |
| SCHEMBL10403241 | 0.86 | DHODH (0.37) | ALDH1A1IDO1STAT3KDM4EHPGD | |
| SCHEMBL10385618 | 0.85 | ALDH1A1 (0.52) | ALDH1A1IDO1CYP1A2CYP3A4MAPK1 | |
| SCHEMBL10404697 | 0.77 | ALDH1A1 (0.49) | ALDH1A1IDO1CYP1A2CYP3A4MAPK1 | |
| SCHEMBL10777266 | 0.71 | MEN1 (0.55) | ALDH1A1CYP1A2MAPK1STAT3KDM4E | |
| SCHEMBL10771130 | 0.71 | NPC1 (0.37) | ALDH1A1STAT3GAAMEN1KMT2A | |
| SCHEMBL13312621 | 0.70 | ALDH1A1 (0.62) | ALDH1A1MAPK1KDM4EMEN1KMT2A | |
| SCHEMBL14177932 | 0.69 | SMN1; SMN2 (0.49) | ALDH1A1KDM4EMEN1KMT2AMAPT | |
| SCHEMBL10385637 | 0.68 | ALDH1A1 (0.52) | ALDH1A1IDO1CYP1A2CYP3A4MAPK1 | |
| SCHEMBL4755207 | 0.67 | RECQL (0.64) | ALDH1A1KDM4EMEN1KMT2ARECQL |
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-4923868-A | BACTERICIDES | AMERICAN CYANAMID COMPANY (US) | 1990-05-08 | — | — | US | claimed |