Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2219429 | 0.88 | PTGS1 (0.59) | KMT2APTGS1PTGS2ALDH1A1GAA | |
| SCHEMBL2219061 | 0.83 | PTGS1 (0.60) | KMT2APTGS1PTGS2ALDH1A1GAA | |
| SCHEMBL7949551 | 0.79 | KDM4E (0.47) | KMT2APTGS1PTGS2ALDH1A1GAA | |
| SCHEMBL13766094 | 0.77 | ENPP2 (0.55) | KMT2APTGS1PTGS2ALDH1A1GAA | |
| SCHEMBL6101487 | 0.77 | PTGS1 (0.59) | PTGS1PTGS2ALDH1A1GAAKDM4E | |
| SCHEMBL7949047 | 0.75 | KDM4E (0.41) | PTGS1PTGS2ALDH1A1GAAKDM4E | |
| SCHEMBL20100081 | 0.75 | ALDH1A1 (0.68) | KMT2APTGS1PTGS2ALDH1A1GAA | |
| SCHEMBL17718399 | 0.75 | PTGS1 (0.53) | KMT2APTGS1PTGS2ALDH1A1GAA | |
| SCHEMBL22817530 | 0.74 | KMT2A (0.55) | KMT2APTGS1PTGS2ALDH1A1GAA | |
| SCHEMBL18412790 | 0.74 | PTGS1 (0.73) | KMT2APTGS1PTGS2ALDH1A1GAA |
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-2009154300-A2 | HETEROCYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-12-23 | — | — | WO | disclosed |