Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | APP | P05067 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SNCA | P37840 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | DBH | P09172 | 1/20 | 0.37 |
| ▸ | F2R | P25116 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6561713 | 0.81 | ALDH1A1 (0.48) | ALDH1A1APPGAAL3MBTL1SNCA | |
| SCHEMBL6561562 | 0.78 | PLA2G2A (0.37) | ALDH1A1GAAMEN1KMT2ACYP19A1 | |
| SCHEMBL2002745 | 0.77 | SRD5A1 (0.34) | ALDH1A1GAAMEN1KMT2AXDH | |
| SCHEMBL6561697 | 0.68 | BIRC5 (0.38) | ALDH1A1GAAHTTMEN1KMT2A | |
| SCHEMBL6398012 | 0.66 | SRD5A1 (0.49) | ALDH1A1GAAPOLBMEN1KMT2A | |
| SCHEMBL6085877 | 0.66 | HTR6 (0.53) | ALDH1A1APPSNCAHTR6SMN1; SMN2 | |
| SCHEMBL122228 | 0.65 | HTR6 (0.52) | ALDH1A1APPSNCAHTR6SMN1; SMN2 | |
| SCHEMBL6086279 | 0.65 | HTR6 (0.52) | ALDH1A1HTR6SMN1; SMN2LMNAHTT | |
| SCHEMBL31668340 | 0.65 | ALDH1A1 (0.68) | ALDH1A1APPSNCAHTR6SMN1; SMN2 | |
| SCHEMBL7856928 | 0.65 | SRD5A1 (0.40) | ALDH1A1LMNAMEN1KMT2APLA2G2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0904079-B1 | ANTIDIABETIC AGENTS | MERCK & CO INC (US) | 2004-03-24 | — | — | EP | disclosed |
| EP-0904079-A4 | — | — | 1999-05-06 | — | — | EP | disclosed |
| EP-0904079-A1 | ANTIDIABETIC AGENTS | Merck & Co., Inc. (US) | 1999-03-31 | — | — | EP | disclosed |
| US-5859051-A | ACETYLPHENOL DERIVATIVES | MERCK & CO., INC. (US) | 1999-01-12 | — | — | US | disclosed |
| WO-1997027857-A1 | ANTIDIABETIC AGENTS | MERCK & CO., INC. (US) | 1997-08-07 | — | — | WO | disclosed |