Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 3/20 | 0.62 |
| ▸ | CES1 | P23141 | 3/20 | 0.57 |
| ▸ | CES2 | O00748 | 2/20 | 0.57 |
| ▸ | IDO1 | P14902 | 1/20 | 0.49 |
| ▸ | CDC25A | P30304 | 1/20 | 0.49 |
| ▸ | CDC25B | P30305 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | LCK | P06239 | 2/20 | 0.46 |
| ▸ | GAPDH | P04406 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL19853370 | 0.93 | PTPN1 (0.62) | PTPN1CES1CES2IDO1CDC25A | |
| SCHEMBL9067171 | 0.89 | IDO1 (0.52) | PTPN1CES1CES2IDO1CDC25A | |
| SCHEMBL30492234 | 0.89 | IDO1 (0.52) | PTPN1CES1CES2IDO1CDC25A | |
| SCHEMBL5822222 | 0.86 | IDO1 (0.62) | PTPN1CES1CES2IDO1CDC25A | |
| SCHEMBL30003084 | 0.86 | IDO1 (0.62) | PTPN1CES1CES2IDO1CDC25A | |
| SCHEMBL5809726 | 0.82 | IDO1 (0.62) | PTPN1CES1CES2IDO1CDC25A | |
| SCHEMBL7451901 | 0.78 | CA1 (0.57) | PTPN1IDO1CA1CA2CA4 | |
| SCHEMBL7786812 | 0.78 | CA1 (0.57) | PTPN1IDO1CA1CA2CA4 | |
| SCHEMBL2252533 | 0.78 | CA1 (0.57) | PTPN1IDO1CA1CA2CA4 | |
| SCHEMBL28155812 | 0.78 | CA1 (0.57) | PTPN1IDO1CA1CA2CA4 |
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-2018025259-A1 | ENZYME INHIBITORS | TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) | 2018-02-08 | — | — | WO | disclosed |