Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.55 |
| ▸ | TSHR | P16473 | 5/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18762840 | 0.87 | CHRNA7 (0.43) | ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL346292 | 0.79 | ALDH1A1 (0.61) | ALDH1A1TSHRALOX15HSD17B10SLC2A1 | |
| SCHEMBL11230687 | 0.79 | TYR (0.42) | KMT2AMEN1MAPTHIF1A | |
| SCHEMBL3893552 | 0.79 | ALDH1A1 (0.61) | ALDH1A1TSHRALOX15HSD17B10SLC2A1 | |
| SCHEMBL10145543 | 0.79 | ALDH1A1 (0.61) | ALDH1A1TSHRALOX15HSD17B10SLC2A1 | |
| SCHEMBL12313 | 0.77 | CHRNA7 (0.61) | ALDH1A1TSHRTDP1KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL2861214 | 0.77 | ALDH1A1 (0.58) | ALDH1A1TSHRALOX15HSD17B10SLC2A1 | |
| SCHEMBL61574 | 0.76 | SLC2A1 (0.71) | ALDH1A1TSHRALOX15HSD17B10SLC2A1 | |
| SCHEMBL9626237 | 0.76 | SLC2A1 (0.71) | ALDH1A1TSHRALOX15HSD17B10SLC2A1 | |
| SCHEMBL18509390 | 0.75 | ALDH1A1 (0.55) | ALDH1A1TSHRALOX15HSD17B10SLC2A1 |
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-2004110997-A1 | 3- SULFONYLAMINO- PYRROLIDINE- 2- ONE DERIVATIVES AS INHIBITORS OF FACTOR XA | GLAXO GROUP LIMITED (GB) | 2004-12-23 | — | — | WO | disclosed |