Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6985322 | 0.92 | GAA (0.41) | ALDH1A1KMT2AMEN1PKMGAA | |
| SCHEMBL7411038 | 0.92 | PKM (0.43) | ALDH1A1KMT2AMEN1PKMGAA | |
| SCHEMBL7408050 | 0.92 | TP53 (0.40) | ALDH1A1KMT2AMEN1PKMGAA | |
| SCHEMBL6982764 | 0.92 | FPR1 (0.43) | ALDH1A1KMT2AMEN1PKMGAA | |
| SCHEMBL6984759 | 0.92 | LMNA (0.47) | ALDH1A1KMT2AMEN1PKMGAA | |
| SCHEMBL6981583 | 0.91 | STAT3 (0.49) | ALDH1A1KMT2AMEN1MAPK1PKM | |
| SCHEMBL6983600 | 0.88 | MAPT (0.40) | ALDH1A1KMT2AMEN1PKMGAA | |
| SCHEMBL6982163 | 0.88 | SLC16A3 (0.45) | ALDH1A1KMT2AMEN1PKMGAA | |
| SCHEMBL7414191 | 0.87 | PKM (0.42) | ALDH1A1KMT2AMEN1PKMGAA | |
| SCHEMBL6977498 | 0.87 | CCKBR (0.44) | ALDH1A1KMT2AMEN1PKMGAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0991624-B1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA (DE) | 2003-11-19 | — | — | EP | disclosed |
| EP-0991624-A1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | Boehringer Ingelheim Pharma KG (DE) | 2000-04-12 | — | — | EP | disclosed |
| WO-1999000371-A1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1999-01-07 | — | — | WO | disclosed |