Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CRHBP | P24387 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.42 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.41 |
| ▸ | FNTA | P49354 | 1/20 | 0.41 |
| ▸ | FNTB | P49356 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7073376 | 0.88 | ALDH1A1 (0.46) | ALDH1A1KMT2AHSD11B1KCNA5MMP13 | |
| SCHEMBL7079124 | 0.87 | ALDH1A1 (0.45) | ALDH1A1MEN1KMT2ALMNANPSR1 | |
| SCHEMBL7077840 | 0.85 | GABBR2 (0.49) | ALDH1A1MAPTHSD11B1FNTAFNTB | |
| SCHEMBL7077860 | 0.85 | GABBR2 (0.49) | ALDH1A1MAPTHSD11B1FNTAFNTB | |
| SCHEMBL7079922 | 0.84 | MMP2 (0.43) | ALDH1A1HSD11B1KCNA5FNTAFNTB | |
| SCHEMBL7077837 | 0.84 | ALDH1A1 (0.45) | ALDH1A1MEN1KMT2ALMNACYP3A4 | |
| SCHEMBL7075400 | 0.82 | F2 (0.45) | ALDH1A1KCNA5POLBMMP13MMP2 | |
| SCHEMBL7078814 | 0.82 | MMP13 (0.48) | ALDH1A1FNTAFNTBMMP13MMP2 | |
| SCHEMBL7073767 | 0.81 | MMP13 (0.49) | ALDH1A1MEN1KMT2ACYP2C9CYP2C19 | |
| SCHEMBL7078057 | 0.79 | HSD11B1 (0.48) | ALDH1A1MEN1KMT2AMAPTLMNA |
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 1 patent. 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 |