Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | CCR8 | P51685 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | POLB | P06746 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7136490 | 0.81 | KCNH2 (0.68) | ALDH1A1TDP1TSHRCCR8RAB9A | |
| SCHEMBL6503652 | 0.80 | CCR8 (0.59) | ALDH1A1TDP1TSHRCCR8RECQL | |
| SCHEMBL1749330 | 0.78 | MAPT (0.68) | ALDH1A1TDP1TSHRRECQLKMT2A | |
| SCHEMBL10148089 | 0.76 | POLB (0.52) | ALDH1A1TDP1RECQLKMT2APKM | |
| SCHEMBL5517458 | 0.76 | POLB (0.52) | ALDH1A1TDP1RECQLKMT2APKM | |
| SCHEMBL1505913 | 0.75 | ALDH1A1 (0.75) | ALDH1A1TDP1TSHRCCR8RECQL | |
| SCHEMBL3339277 | 0.75 | TSHR (0.67) | ALDH1A1TSHRKMT2APKMPOLB | |
| SCHEMBL8635900 | 0.75 | LTA4H (0.52) | ALDH1A1TSHRKMT2APKMMEN1 | |
| SCHEMBL15578186 | 0.74 | POLB (0.50) | ALDH1A1TDP1TSHRRECQLKMT2A | |
| SCHEMBL805959 | 0.74 | SCN9A (0.61) | ALDH1A1TSHRKMT2AMEN1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-5723492-A | LTA4 hydrolase inhibitor pharmaceutical compositions and methods of use | G.D. SEARLE & CO. (US) | 1998-03-03 | — | — | US | disclosed |
| US-5719306-A | ANTIINFLAMMATORY AGENTS | G.D. SEARLE & CO. (US) | 1998-02-17 | — | — | US | disclosed |