Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 3/20 | 0.35 |
| ▸ | ANPEP | P15144 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.31 |
| ▸ | DRD2 | P14416 | 2/20 | 0.31 |
| ▸ | DRD3 | P35462 | 2/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | DRD1 | P21728 | 1/20 | 0.31 |
| ▸ | DRD4 | P21917 | 1/20 | 0.31 |
| ▸ | DRD5 | P21918 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19505804 | 0.85 | KMT2A (0.44) | ALDH1A1GAATSHRMMP2ANPEP | |
| SCHEMBL19505802 | 0.85 | KMT2A (0.44) | ALDH1A1GAATSHRMMP2ANPEP | |
| SCHEMBL19506177 | 0.81 | TSHR (0.38) | ALDH1A1GAATSHRMMP2ANPEP | |
| SCHEMBL19506080 | 0.81 | KMT2A (0.33) | ALDH1A1GAATSHRMMP2ANPEP | |
| SCHEMBL19506184 | 0.79 | CA12 (0.35) | ALDH1A1MMP2ANPEPKMT2ACA12 | |
| SCHEMBL19506186 | 0.76 | PKM (0.43) | ALDH1A1GAAMMP2ANPEPKMT2A | |
| SCHEMBL14663320 | 0.75 | NR1H2 (0.39) | MMP2ANPEPKMT2A | |
| SCHEMBL30181072 | 0.75 | NR1H2 (0.39) | MMP2ANPEPKMT2A | |
| SCHEMBL14672225 | 0.75 | NR1H2 (0.39) | MMP2ANPEPKMT2A | |
| SCHEMBL12283471 | 0.75 | KDM4E (0.42) | ALDH1A1L3MBTL1LMNA |
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-2017184558-A1 | NOVEL PROMYSALIN ANALOGUES AND METHODS OF USE THEREOF | TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2017-10-26 | — | — | WO | disclosed |