Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APAF1 | O14727 | 11/20 | 0.63 |
| ▸ | NPC1 | O15118 | 5/20 | 0.63 |
| ▸ | RAB9A | P51151 | 5/20 | 0.63 |
| ▸ | CDC25A | P30304 | 1/20 | 0.62 |
| ▸ | CDC25B | P30305 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 13/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.62 |
| ▸ | HTT | P42858 | 6/20 | 0.62 |
| ▸ | POLB | P06746 | 5/20 | 0.62 |
| ▸ | LMNA | P02545 | 5/20 | 0.62 |
| ▸ | MITF | O75030 | 3/20 | 0.62 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.62 |
| ▸ | L3MBTL1 | Q9Y468 | 7/20 | 0.54 |
| ▸ | MEN1 | O00255 | 7/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.54 |
| ▸ | GAA | P10253 | 6/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.54 |
| ▸ | NSD2 | O96028 | 3/20 | 0.54 |
| ▸ | CASP3 | P42574 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL7245820 | 0.90 | APAF1 (0.62) | APAF1NPC1RAB9ACDC25ACDC25B | |
| SCHEMBL7253110 | 0.88 | APAF1 (0.62) | APAF1NPC1RAB9ACDC25ACDC25B | |
| SCHEMBL7240512 | 0.86 | MAPT (0.65) | APAF1NPC1RAB9ACDC25ACDC25B | |
| SCHEMBL7240441 | 0.84 | MAPT (0.69) | APAF1NPC1RAB9ACDC25ACDC25B | |
| SCHEMBL7241156 | 0.82 | APAF1 (0.61) | APAF1NPC1RAB9ACDC25ACDC25B | |
| SCHEMBL7248456 | 0.81 | CDC25A (0.59) | APAF1NPC1RAB9ACDC25ACDC25B | |
| SCHEMBL2467093 | 0.80 | APAF1 (0.80) | APAF1NPC1RAB9ACDC25ACDC25B | |
| SCHEMBL7247910 | 0.79 | APAF1 (0.76) | APAF1NPC1RAB9ACDC25ACDC25B | |
| SCHEMBL4874221 | 0.79 | APAF1 (0.97) | APAF1NPC1RAB9ACDC25ACDC25B | |
| SCHEMBL4872810 | 0.79 | MAPT (0.76) | APAF1NPC1RAB9ACDC25ACDC25B |
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 |
|---|---|---|---|---|---|---|---|
| US-6630589-B1 | Screening assays for compounds that are potentially useful for treating or preventing a proliferative disease. The assays are based on contacting a candidate compound with a cell containing a nucleic acid including a HER2 regulatory element | MESSAGE PHARMACEUTICALS | 2003-10-07 | — | — | US | disclosed |