Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | KCNA5 | P22460 | 3/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 2/20 | 0.40 |
| ▸ | MMP2 | P08253 | 2/20 | 0.40 |
| ▸ | MMP3 | P08254 | 2/20 | 0.40 |
| ▸ | PDE4A | P27815 | 2/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | ESRRB | O95718 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | F10 | P00742 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 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 | |
|---|---|---|---|---|
| SCHEMBL7079124 | 0.88 | ALDH1A1 (0.45) | ALDH1A1KMT2AKCNA5HSD11B1MMP13 | |
| SCHEMBL7079059 | 0.88 | ALDH1A1 (0.45) | ALDH1A1KMT2AKCNA5HSD11B1MMP13 | |
| SCHEMBL7077837 | 0.85 | ALDH1A1 (0.45) | ALDH1A1KMT2AKCNA5MMP13MMP2 | |
| SCHEMBL7073753 | 0.85 | GABBR2 (0.50) | ALDH1A1KMT2AHSD11B1MMP2 | |
| SCHEMBL7073761 | 0.84 | KMT2A (0.40) | ALDH1A1KMT2A | |
| SCHEMBL7078814 | 0.83 | MMP13 (0.48) | ALDH1A1MMP13MMP2MMP3PDE4A | |
| SCHEMBL7075400 | 0.83 | F2 (0.45) | ALDH1A1KCNA5MMP13MMP2CA12 | |
| SCHEMBL7079922 | 0.83 | MMP2 (0.43) | ALDH1A1KCNA5HSD11B1MMP13MMP2 | |
| SCHEMBL7073767 | 0.82 | MMP13 (0.49) | ALDH1A1KMT2AKCNA5MMP13MMP2 | |
| SCHEMBL7078057 | 0.81 | HSD11B1 (0.48) | ALDH1A1KMT2AHSD11B1CA12CA9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003059872-A1 | AVB3 AND AVB5 INTEGRIN ANTAGONISTS AND METHODS OF TREATING DISEASES OR CONDITIONS ASSOCIATED WITH AVB3 AND AVB5 INTEGRINS | BAYER PHARMACEUTICALS CORPORATION (US) | 2003-07-24 | — | — | WO | disclosed |
| WO-2003059872-A1 | AVB3 AND AVB5 INTEGRIN ANTAGONISTS AND METHODS OF TREATING DISEASES OR CONDITIONS ASSOCIATED WITH AVB3 AND AVB5 INTEGRINS | BAYER PHARMACEUTICALS CORPORATION (US) | 2003-07-24 | — | — | WO | disclosed |