Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 6/20 | 0.42 |
| ▸ | RAB9A | P51151 | 6/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | TP53 | P04637 | 3/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.42 |
| ▸ | RELA | Q04206 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | BLM | P54132 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7522548 | 0.82 | MT-CO2 (0.51) | KDM4ESMN1; SMN2NPC1RAB9ALMNA | |
| SCHEMBL7559674 | 0.81 | SMN1; SMN2 (0.44) | KDM4ESMN1; SMN2TDP1NPC1RAB9A | |
| SCHEMBL8210609 | 0.79 | RAB9A (0.50) | KDM4ESMN1; SMN2TDP1NPC1RAB9A | |
| SCHEMBL7528545 | 0.68 | KDM4E (0.58) | KDM4ESMN1; SMN2TDP1NPC1RAB9A | |
| SCHEMBL108881 | 0.66 | HPGD (0.78) | KDM4ESMN1; SMN2TDP1NPC1RAB9A | |
| SCHEMBL9516537 | 0.66 | HPGD (0.78) | KDM4ESMN1; SMN2TDP1NPC1RAB9A | |
| SCHEMBL50079 | 0.66 | HPGD (0.78) | KDM4ESMN1; SMN2TDP1NPC1RAB9A | |
| Water SCHEMBL8602751 | 0.63 | HPGD (0.74) | KDM4ESMN1; SMN2TDP1NPC1RAB9A | |
| SCHEMBL19675165 | 0.62 | HPGD (0.45) | KDM4ESMN1; SMN2TDP1NPC1RAB9A | |
| SCHEMBL1921510 | 0.60 | HPGD (0.67) | SMN1; SMN2TDP1NPC1RAB9ALMNA |
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-1173420-A2 | HETEROCYCLIC COMPOUNDS HAVING ANTITUMOR ACTIVITY | Novuspharma S.p.A. (IT) | 2002-01-23 | — | — | EP | disclosed |
| WO-2000053581-A2 | HETEROCYCLIC COMPOUNDS HAVING ANTITUMOR ACTIVITY | NOVUSPHARMA S.P.A. (IT) | 2000-09-14 | — | — | WO | disclosed |