Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8805656 | 0.83 | ALDH1A1 (0.47) | ALDH1A1KMT2AMEN1GAAHPGD | |
| SCHEMBL8926621 | 0.83 | TSHR (0.48) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA | |
| SCHEMBL5700815 | 0.82 | ALDH1A1 (0.48) | ALDH1A1KMT2AMEN1CYP2C19L3MBTL1 | |
| SCHEMBL8803643 | 0.81 | TDP1 (0.49) | ALDH1A1SMN1; SMN2KMT2AMEN1L3MBTL1 | |
| SCHEMBL8805421 | 0.78 | ALDH1A1 (0.46) | ALDH1A1KMT2AMEN1CYP2C19MAPT | |
| SCHEMBL8805132 | 0.75 | SLC6A3 (0.50) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA | |
| SCHEMBL27780284 | 0.73 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2KMT2AMEN1HPGD | |
| SCHEMBL18013199 | 0.73 | VCAM1 (0.61) | ALDH1A1KMT2AMEN1HPGDMAPT | |
| SCHEMBL7684130 | 0.70 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA | |
| SCHEMBL29749404 | 0.69 | ALDH1A1 (0.49) | ALDH1A1KMT2AMEN1GAAHPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0569139-A2 | Alkyl substituted nitrotoluene derivatives | ZENECA LIMITED (GB) | 1993-11-10 | — | — | EP | disclosed |