Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 7/20 | 0.39 |
| ▸ | KDR | P35968 | 7/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | SOS1 | Q07889 | 5/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | USP7 | Q93009 | 2/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 4/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL22862431 | 1.00 | EGFR (0.39) | EGFRKDRCA1CA2CA9 | |
| SCHEMBL22862811 | 1.00 | EGFR (0.39) | EGFRKDRCA1CA2CA9 | |
| SCHEMBL22862998 | 0.93 | EGFR (0.38) | EGFRKDRSOS1SMN1; SMN2PDGFRB | |
| SCHEMBL29490251 | 0.91 | CA1 (0.40) | EGFRCA1CA2CA9SOS1 | |
| SCHEMBL22862603 | 0.91 | CA1 (0.40) | EGFRCA1CA2CA9SOS1 | |
| SCHEMBL22862723 | 0.91 | CA1 (0.40) | EGFRCA1CA2CA9NPC1 | |
| SCHEMBL29490217 | 0.91 | CA1 (0.40) | EGFRCA1CA2CA9NPC1 | |
| SCHEMBL22862729 | 0.91 | CA1 (0.38) | EGFRCA1CA2CA9SOS1 | |
| SCHEMBL22862630 | 0.91 | CA1 (0.40) | EGFRCA1CA2CA9NPC1 | |
| SCHEMBL22862753 | 0.88 | CCNE2 (0.39) | EGFRKDRCA1CA2CA9 |
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-3976009-A2 | BAX INHIBITORS AND USES THEREOF | Case Western Reserve University (US) | 2022-04-06 | — | — | EP | disclosed |