Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 10/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL92862 | 0.74 | KMT2A (0.59) | KMT2AALOX5 | |
| SCHEMBL28752490 | 0.73 | MGLL (0.62) | ENPP2 | |
| SCHEMBL8506107 | 0.73 | PTGS2 (0.40) | ENPP2PTGS2PTGS1 | |
| SCHEMBL2376239 | 0.72 | ENPP2 (0.72) | ENPP2PTGS2 | |
| SCHEMBL15167579 | 0.72 | CA12 (0.54) | KMT2AENPP2PTGS2AKR1C3 | |
| SCHEMBL8797691 | 0.72 | MAOA (0.61) | KMT2AENPP2 | |
| SCHEMBL3433957 | 0.71 | CA2 (0.52) | ENPP2PTGS2AKR1C3 | |
| SCHEMBL8505532 | 0.71 | LMNA (0.44) | PTGS2PTGS1 | |
| SCHEMBL20649339 | 0.70 | KMT2A (0.59) | KMT2AENPP2 | |
| SCHEMBL14282014 | 0.69 | MGLL (0.57) | KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5254679-A | Containing a quaternized nitrogen | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-10-19 | — | — | US | disclosed |
| EP-0164944-A1 | Cephalosporin derivatives | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1985-12-18 | — | — | EP | disclosed |