Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP12 | P39900 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | EP300 | Q09472 | 1/20 | 0.39 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.39 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL7305235 | 0.85 | MMP1 (0.47) | MMP2MMP9MMP12NPC1TP53 | |
| SCHEMBL7303726 | 0.84 | ALDH1A1 (0.44) | ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL7307399 | 0.83 | ALDH1A1 (0.43) | ALDH1A1HPGDMAPTMEN1KMT2A | |
| SCHEMBL6658727 | 0.79 | ADAM17 (0.47) | ALDH1A1MMP2MMP9KMT2A | |
| SCHEMBL618046 | 0.78 | FFAR1 (0.41) | HSD11B1ALDH1A1HPGDTSHRCYP2C19 | |
| SCHEMBL7303615 | 0.77 | SCN5A (0.49) | TSHRMMP2MMP9CYP2C19NPC1 | |
| SCHEMBL364190 | 0.73 | HSD11B1 (0.65) | HSD11B1ALDH1A1HPGDTSHRCYP3A4 | |
| SCHEMBL9637668 | 0.71 | ALDH1A1 (0.40) | ALDH1A1HPGDTSHR | |
| SCHEMBL7306362 | 0.71 | MMP1 (0.49) | ALDH1A1MMP2MMP9MMP12MAPT | |
| SCHEMBL11619962 | 0.71 | SLC6A4 (0.45) | ALDH1A1HPGDCA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0780386-B1 | Matrix metalloprotease inhibitors | HOFFMANN LA ROCHE (CH) | 2002-10-02 | — | — | EP | disclosed |
| EP-0780386-A1 | Matrix metalloprotease inhibitors | F. HOFFMANN-LA ROCHE AG (CH) | 1997-06-25 | — | — | EP | disclosed |