Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 3/20 | 0.61 |
| ▸ | MMP3 | P08254 | 1/20 | 0.56 |
| ▸ | CA12 | O43570 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | CA9 | Q16790 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.44 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.44 |
| ▸ | CA3 | P07451 | 1/20 | 0.44 |
| ▸ | CA6 | P23280 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | NOS3 | P29474 | 2/20 | 0.43 |
| ▸ | NOS1 | P29475 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13063633 | 0.84 | MMP3 (0.74) | KIF11MMP3CA12CA2CA9 | |
| Water SCHEMBL11055485 | 0.84 | MMP3 (0.74) | KIF11MMP3CA12CA2CA9 | |
| SCHEMBL26246 | 0.84 | MMP3 (0.74) | KIF11MMP3CA12CA2CA9 | |
| SCHEMBL396846 | 0.84 | MMP3 (0.74) | KIF11MMP3CA12CA2CA9 | |
| Chloromethane SCHEMBL28514005 | 0.83 | KIF11 (0.59) | KIF11MMP3CA12CA2CA9 | |
| Acetone SCHEMBL3433409 | 0.81 | MMP3 (0.58) | KIF11MMP3CA12CA2CA9 | |
| Methane SCHEMBL28372042 | 0.81 | MMP3 (0.70) | KIF11MMP3CA12CA2CA9 | |
| Methylhydrazine SCHEMBL3435836 | 0.78 | MMP3 (0.54) | KIF11MMP3CA12CA2CA9 | |
| SCHEMBL12377032 | 0.77 | CYP2A6 (0.84) | KIF11MMP3CA12CA2CA9 | |
| SCHEMBL1006683 | 0.77 | MMP3 (0.58) | KIF11MMP3CA12CA2CA9 |
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-2010146391-A1 | REGIOSELECTIVE SYNTHESIS OF LETROZOLE | GENERICS [UK] LIMITED (GB) | 2010-12-23 | — | — | WO | claimed |