Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA5A | P35218 | 1/20 | 0.49 |
| ▸ | CA7 | P43166 | 1/20 | 0.49 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL1291430 | 0.84 | TAAR1 (0.66) | CA7ALDH1A1TAAR1HDAC2HDAC8 | |
| SCHEMBL30515391 | 0.83 | HPGD (0.67) | EPHX2SMN1; SMN2NPC1RAB9ACA1 | |
| SCHEMBL16353654 | 0.83 | ALDH1A1 (0.56) | EPHX2SMN1; SMN2NPC1RAB9ACA1 | |
| SCHEMBL3931226 | 0.82 | NAMPT (0.48) | SMN1; SMN2NPC1RAB9ACA7ALDH1A1 | |
| SCHEMBL1291594 | 0.82 | HPGD (0.50) | ALDH1A1TAAR1 | |
| SCHEMBL13915580 | 0.81 | SPR (0.58) | EPHX2SMN1; SMN2NPC1RAB9ACA1 | |
| SCHEMBL27447850 | 0.81 | EPHX2 (0.58) | EPHX2SMN1; SMN2NPC1RAB9ACA1 | |
| Iodide SCHEMBL20475497 | 0.80 | NAMPT (0.47) | SMN1; SMN2NPC1RAB9ACA7ALDH1A1 | |
| SCHEMBL12313360 | 0.79 | SMN1; SMN2 (0.58) | EPHX2SMN1; SMN2NPC1RAB9ACA1 | |
| SCHEMBL22281950 | 0.79 | SMN1; SMN2 (0.58) | SMN1; SMN2NPC1RAB9ACA1CA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0815103-A1 | TRYPSIN AND THROMBIN INHIBITORS | Novartis AG (CH) | 1998-01-07 | — | — | EP | disclosed |
| WO-1996029327-A1 | TRYPSIN AND THROMBIN INHIBITORS | NOVARTIS AG (CH) | 1996-09-26 | — | — | WO | disclosed |