Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.54 |
| ▸ | ACHE | P22303 | 2/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | F2 | P00734 | 2/20 | 0.45 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.45 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.45 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7078459 | 0.79 | ALDH1A1 (0.48) | ALDH1A1LMNAF2PRSS1PRSS2 | |
| SCHEMBL8789501 | 0.78 | F2 (0.53) | ALDH1A1F2PRSS1PRSS2PRSS3 | |
| SCHEMBL6100059 | 0.76 | F2 (0.56) | ALDH1A1LMNAF2PRSS1PRSS2 | |
| SCHEMBL5638579 | 0.76 | CA12 (0.57) | ALDH1A1ACHEBCHELMNAGAA | |
| SCHEMBL5929473 | 0.75 | ACHE (0.71) | ALDH1A1ACHELMNAGAANPC1 | |
| SCHEMBL7310589 | 0.74 | F2 (0.56) | ALDH1A1F2PRSS1PRSS2PRSS3 | |
| SCHEMBL8789462 | 0.74 | F2 (0.49) | ALDH1A1F2PRSS1PRSS2PRSS3 | |
| SCHEMBL8340327 | 0.73 | ALDH1A1 (0.76) | ALDH1A1LMNANPC1MEN1KMT2A | |
| SCHEMBL8789808 | 0.72 | ALDH1A1 (0.54) | ALDH1A1LMNAF2PRSS1PRSS2 | |
| SCHEMBL9078382 | 0.72 | TSHR (0.55) | LMNAGAANPC1MAPT |
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-5948780-A | ADMINISTERING A METALLOPROTEINASE INHIBITOR | WARNER-LAMBERT COMPANY (US) | 1999-09-07 | — | — | US | disclosed |