Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31299205 | 0.85 | ALDH1A1 (0.53) | ALDH1A1MEN1KMT2AMAPTHTT | |
| SCHEMBL5527291 | 0.78 | HDAC8 (0.61) | ALDH1A1MEN1KMT2AMAPTHTT | |
| SCHEMBL5511001 | 0.78 | HDAC8 (0.61) | ALDH1A1MEN1KMT2AMAPTHTT | |
| SCHEMBL14823816 | 0.78 | HDAC8 (0.61) | ALDH1A1MEN1KMT2AMAPTHTT | |
| SCHEMBL23192018 | 0.78 | HDAC8 (0.61) | ALDH1A1MEN1KMT2AMAPTHTT | |
| SCHEMBL293980 | 0.78 | HDAC8 (0.61) | ALDH1A1MEN1KMT2AMAPTHTT | |
| SCHEMBL5515422 | 0.78 | HDAC8 (0.61) | ALDH1A1MEN1KMT2AMAPTHTT | |
| SCHEMBL5520084 | 0.78 | HDAC8 (0.61) | ALDH1A1MEN1KMT2AMAPTHTT | |
| SCHEMBL21380115 | 0.78 | — | — | |
| SCHEMBL14823812 | 0.78 | HDAC8 (0.61) | ALDH1A1MEN1KMT2AMAPTHTT |
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-2021252800-A1 | METHODS AND SYSTEMS FOR COMPUTATIONAL DECODING OF BIOLOGICAL, CHEMICAL, AND PHYSICAL ENTITIES | NAUTILUS BIOTECHNOLOGY, INC. (US) | 2021-12-16 | — | — | WO | disclosed |