Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | MMP1 | P03956 | 1/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.48 |
| ▸ | MMP3 | P08254 | 1/20 | 0.48 |
| ▸ | PDE4A | P27815 | 1/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.48 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | PPARG | P37231 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7032170 | 0.81 | ACE (0.50) | EPHX1ALDH1A1L3MBTL1CYP2C19POLB | |
| SCHEMBL6571679 | 0.80 | CYP2C19 (0.74) | EPHX1ALDH1A1L3MBTL1CYP2C19POLB | |
| SCHEMBL728401 | 0.80 | NPC1 (0.56) | EPHX1ALDH1A1L3MBTL1CYP2C19NPC1 | |
| SCHEMBL18065709 | 0.80 | ALDH1A1 (0.62) | ALDH1A1NPC1RAB9AMMP3KMT2A | |
| SCHEMBL11020143 | 0.78 | ALDH1A1 (0.51) | EPHX1ALDH1A1L3MBTL1NPC1RAB9A | |
| SCHEMBL1858556 | 0.78 | GRIK1 (0.49) | NPC1RAB9ASMN1; SMN2PPARGPPARA | |
| SCHEMBL10641858 | 0.78 | MMP2 (0.58) | ALDH1A1CYP2C19RAB9ACYP2C9MMP2 | |
| SCHEMBL7034263 | 0.78 | L3MBTL1 (0.50) | EPHX1ALDH1A1L3MBTL1RAB9AMMP1 | |
| SCHEMBL7101476 | 0.77 | L3MBTL1 (0.55) | EPHX1ALDH1A1L3MBTL1CYP2C19POLB | |
| SCHEMBL11018640 | 0.77 | EPHX1 (0.50) | EPHX1ALDH1A1L3MBTL1NPC1RAB9A |
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-0158947-A2 | Amino thiol dipeptides | E.R. Squibb & Sons, Inc. (US) | 1985-10-23 | — | — | EP | disclosed |