Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 10/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | PDE4A | P27815 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL7563697 | 0.89 | EPHX1 (0.51) | EPHX1KDM4EALDH1A1CA12CA1 | |
| SCHEMBL13900766 | 0.78 | EPHX1 (0.44) | EPHX1KDM4EALDH1A1CA12CA1 | |
| SCHEMBL7560180 | 0.76 | KMT2A (0.51) | EPHX1KDM4EALDH1A1KMT2AEPHX2 | |
| SCHEMBL19998148 | 0.75 | KMT2A (0.65) | EPHX1KDM4EALDH1A1KMT2AEPHX2 | |
| SCHEMBL14423984 | 0.74 | EPHX1 (0.50) | EPHX1KDM4EALDH1A1CA12CA1 | |
| SCHEMBL15225976 | 0.72 | NPSR1 (0.53) | EPHX1KDM4EALDH1A1KMT2AEPHX2 | |
| SCHEMBL25860152 | 0.71 | ADRA2A (0.74) | EPHX1KDM4EALDH1A1CA12CA1 | |
| SCHEMBL17348043 | 0.70 | PAOX (0.44) | ALDH1A1CA12CA1CA9 | |
| SCHEMBL9547537 | 0.70 | USP2 (0.50) | EPHX1KDM4EALDH1A1KMT2AEPHX2 | |
| SCHEMBL3483037 | 0.70 | EPHX1 (0.45) | EPHX1KDM4EALDH1A1EPHX2ADRA2A |
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-2019072978-A1 | MITOCHONDRIAL INHIBITORS FOR THE TREATMENT OF PROLIFERATION DISORDERS | Basilea Pharmaceutica International AG (CH) | 2019-04-18 | — | — | WO | disclosed |