Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | PSMB8 | P28062 | 2/20 | 0.34 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.34 |
| ▸ | PSMB10 | P40306 | 2/20 | 0.34 |
| ▸ | PSMB2 | P49721 | 2/20 | 0.34 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7584650 | 0.95 | KMT2A (0.37) | NPC1KMT2AALOX15ALDH1A1GAA | |
| SCHEMBL7584054 | 0.92 | KMT2A (0.39) | NPC1KMT2AALOX15ALDH1A1GAA | |
| SCHEMBL7587276 | 0.90 | KMT2A (0.37) | NPC1KMT2AALOX15ALDH1A1GAA | |
| SCHEMBL8501049 | 0.83 | HSD11B1 (0.35) | KMT2AALOX15ALDH1A1GAAMEN1 | |
| SCHEMBL7873339 | 0.80 | MCL1 (0.34) | KMT2AALDH1A1BCL2L1MCL1MEN1 | |
| SCHEMBL7876543 | 0.77 | KEAP1 (0.39) | KMT2AALDH1A1GAAMEN1PKM | |
| SCHEMBL6395395 | 0.76 | KEAP1 (0.36) | KMT2AALDH1A1MCL1MEN1KEAP1 | |
| SCHEMBL6387295 | 0.76 | RORC (0.33) | ALDH1A1BCL2L1MCL1POLBRORC | |
| SCHEMBL7458622 | 0.74 | RORC (0.45) | ALDH1A1GAABCL2L1MCL1POLB | |
| SCHEMBL6392313 | 0.73 | KEAP1 (0.37) | KMT2AALDH1A1GAAMEN1PKM |
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 |
|---|---|---|---|---|---|---|---|
| EP-0813542-B1 | AMINO ACID HYDROXYETHYLAMINO SULFONAMIDE RETROVIRAL PROTEASE INHIBITORS | SEARLE & CO (US) | 2002-10-16 | — | — | EP | claimed |