Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 5/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 5/20 | 0.39 |
| ▸ | PIK3CB | P42338 | 5/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL7046802 | 0.76 | PIK3CD (0.40) | ALDH1A1KDM4EMAPTGAASMN1; SMN2 | |
| SCHEMBL9762505 | 0.72 | KMT2A (0.44) | ALDH1A1KDM4EMAPTSMN1; SMN2CYP1A2 | |
| SCHEMBL9762334 | 0.72 | ALDH1A1 (0.41) | ALDH1A1KDM4EMAPTSMN1; SMN2CYP1A2 | |
| SCHEMBL9762538 | 0.71 | SMN1; SMN2 (0.38) | ALDH1A1KDM4EMAPTGAASMN1; SMN2 | |
| SCHEMBL9762582 | 0.70 | PGK1 (0.40) | ALDH1A1MAPTGAASMN1; SMN2CYP1A2 | |
| SCHEMBL3399391 | 0.70 | ALDH1A1 (0.47) | ALDH1A1KDM4EMAPTSMN1; SMN2CYP1A2 | |
| SCHEMBL31178240 | 0.68 | MAPT (0.42) | ALDH1A1KDM4EMAPTSMN1; SMN2HPGD | |
| SCHEMBL9762197 | 0.68 | PGK1 (0.38) | ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL9761837 | 0.67 | CYP1A2 (0.43) | ALDH1A1MAPTGAASMN1; SMN2CYP1A2 | |
| SCHEMBL9761231 | 0.67 | ALDH1A1 (0.41) | ALDH1A1MAPTSMN1; SMN2CYP1A2CYP2C9 |
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-5026694-A | Antitumor agents | THE BRITISH COLUMBIA CANCER FOUNDATION (CA) | 1991-06-25 | — | — | US | disclosed |