Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL18745272 | 0.88 | EPHX1 (0.59) | EPHX1ALDH1A1L3MBTL1NPC1MAPT | |
| SCHEMBL16558896 | 0.84 | EPHX1 (0.65) | EPHX1ALDH1A1L3MBTL1NPC1MAPT | |
| SCHEMBL3071185 | 0.83 | EPHX1 (0.63) | EPHX1ALDH1A1L3MBTL1NPC1MAPT | |
| SCHEMBL3069244 | 0.83 | EPHX1 (0.63) | EPHX1ALDH1A1L3MBTL1NPC1MAPT | |
| SCHEMBL29058306 | 0.82 | EPHX1 (0.62) | EPHX1ALDH1A1L3MBTL1NPC1MAPT | |
| SCHEMBL10268244 | 0.81 | EPHX1 (0.65) | EPHX1ALDH1A1L3MBTL1NPC1MAPT | |
| SCHEMBL5995062 | 0.81 | EPHX1 (0.57) | EPHX1ALDH1A1L3MBTL1NPC1MAPT | |
| SCHEMBL1308365 | 0.81 | EPHX1 (0.60) | EPHX1ALDH1A1L3MBTL1NPC1MAPT | |
| SCHEMBL17977127 | 0.80 | EPHX1 (0.50) | EPHX1ALDH1A1L3MBTL1NPC1MAPT | |
| SCHEMBL25097416 | 0.80 | EPHX1 (0.50) | EPHX1ALDH1A1L3MBTL1NPC1MAPT |
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-9623014-B2 | β-lactamase inhibitor compounds | ENTASIS THERAPEUTICS LIMITED (GB) | 2017-04-18 | — | — | US | disclosed |