Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 5/20 | 0.56 |
| ▸ | PAOX | Q6QHF9 | 3/20 | 0.39 |
| ▸ | SMOX | Q9NWM0 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8638098 | 1.00 | KDM1A (0.56) | KDM1APAOXSMOXKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL8638114 | 0.97 | KDM1A (0.58) | KDM1APAOXSMOXKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL8638119 | 0.97 | KDM1A (0.58) | KDM1APAOXSMOXKDM4EALDH1A1 | |
| SCHEMBL1948513 | 0.91 | KDM1A (0.43) | KDM1APAOXSMOXKDM4EALDH1A1 | |
| SCHEMBL9239392 | 0.89 | KDM1A (0.52) | KDM1APAOXSMOXKDM4EALDH1A1 | |
| SCHEMBL9239386 | 0.89 | KDM1A (0.52) | KDM1APAOXSMOXKDM4EALDH1A1 | |
| SCHEMBL8637561 | 0.89 | KDM1A (0.78) | KDM1APAOXCNR1CNR2KMT2A | |
| SCHEMBL8637555 | 0.89 | KDM1A (0.78) | KDM1APAOXCNR1CNR2KMT2A | |
| Hydrochloric Acid SCHEMBL28850227 | 0.88 | KDM1A (0.46) | KDM1APAOXSMOXKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL3009329 | 0.88 | KDM1A (0.46) | KDM1APAOXSMOXKDM4EALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0686143-B1 | UNSATURATE AMINO COMPOUNDS FOR USE AS ANTICANCER AND ANTIPROTOZOIC AGENT | CIBA GEIGY AG (CH) | 1998-08-12 | — | — | EP | claimed |
| EP-0686143-A1 | UNSATURATE AMINO COMPOUNDS FOR USE AS ANTICANCER AND ANTIPROTOZOIC AGENT | Novartis AG (CH) | 1995-12-13 | — | — | EP | claimed |
| WO-1995018091-A1 | UNSATURATE AMINO COMPOUNDS FOR USE AS ANTICANCER AND ANTIPROTOZOIC AGENT | CIBA-GEIGY AG (CH) | 1995-07-06 | — | — | WO | claimed |