Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 6/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9762260 | 0.72 | ALDH1A1 (0.41) | ALDH1A1CYP1A2CYP2C9KDM4EMAPT | |
| SCHEMBL9762607 | 0.70 | MAPT (0.35) | ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL9761459 | 0.70 | ALDH1A1 (0.39) | ALDH1A1CYP1A2CYP2C9MAPTMAPK1 | |
| SCHEMBL9762513 | 0.69 | MAPT (0.43) | ALDH1A1CYP1A2CYP2C9KDM4EMAPT | |
| SCHEMBL9770626 | 0.69 | KDM4E (0.51) | ALDH1A1CYP1A2CYP2C9KDM4EMAPT | |
| SCHEMBL3399391 | 0.68 | ALDH1A1 (0.47) | ALDH1A1CYP1A2CYP2C9KDM4EMAPT | |
| SCHEMBL9761589 | 0.67 | KMT2A (0.44) | ALDH1A1CYP1A2CYP2C9MAPTMAPK1 | |
| SCHEMBL9762505 | 0.67 | KMT2A (0.44) | ALDH1A1CYP1A2CYP2C9KDM4EMAPT | |
| SCHEMBL13650781 | 0.66 | NUDT1 (0.61) | ALDH1A1CYP1A2KDM4EMAPTMEN1 | |
| SCHEMBL9761837 | 0.64 | CYP1A2 (0.43) | ALDH1A1CYP1A2CYP2C9MAPTMAPK1 |
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 |