Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 3/20 | 0.77 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.74 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | CTDSP1 | Q9GZU7 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | CES2 | O00748 | 1/20 | 0.54 |
| ▸ | CES1 | P23141 | 1/20 | 0.54 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7390281 | 0.93 | GSK3B (0.89) | GSK3BPTPN1NPC1RAB9AMAPT | |
| SCHEMBL202055 | 0.88 | GSK3B (1.00) | GSK3BPTPN1NPC1RAB9AALDH1A1 | |
| SCHEMBL16203309 | 0.87 | KMT2A (0.68) | KMT2ACYP3A4MEN1NPC1RAB9A | |
| Ammonia Solution, Strong SCHEMBL17626749 | 0.86 | GSK3B (0.96) | GSK3BPTPN1NPC1RAB9AALDH1A1 | |
| SCHEMBL316871 | 0.86 | GSK3B (1.00) | GSK3BPTPN1RAB9AALDH1A1MAPT | |
| SCHEMBL22004470 | 0.86 | GSK3B (1.00) | GSK3BPTPN1RAB9AALDH1A1MAPT | |
| SCHEMBL4328500 | 0.84 | GSK3B (0.73) | GSK3BPTPN1KMT2ANPC1RAB9A | |
| SCHEMBL2773360 | 0.83 | GSK3B (0.89) | GSK3BPTPN1NPC1RAB9AALDH1A1 | |
| SCHEMBL1694670 | 0.83 | NPC1 (0.63) | KMT2ACYP3A4MEN1NPC1RAB9A | |
| SCHEMBL31357491 | 0.83 | MAPT (0.78) | KMT2ACYP3A4MEN1NPC1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0973936-A1 | COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS | ELI LILLY AND COMPANY (US) | 2000-01-26 | — | — | EP | disclosed |
| WO-1998046786-A1 | COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS | ELI LILLY AND COMPANY (US) | 1998-10-22 | — | — | WO | disclosed |