Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.34 |
| ▸ | LPL | P06858 | 5/20 | 0.33 |
| ▸ | LIPG | Q9Y5X9 | 5/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.31 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA3 | P07451 | 1/20 | 0.30 |
| ▸ | CA4 | P22748 | 1/20 | 0.30 |
| ▸ | CA6 | P23280 | 1/20 | 0.30 |
| ▸ | CA5A | P35218 | 1/20 | 0.30 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.30 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28969311 | 0.82 | EGFR (0.34) | EGFRLPLLIPGROCK1ESR2 | |
| SCHEMBL23958420 | 0.78 | MTNR1A (0.37) | MTNR1ATP53MAPTSMN1; SMN2MTNR1B | |
| SCHEMBL23929165 | 0.78 | ALDH1A1 (0.39) | MTNR1ATP53MAPTSMN1; SMN2MTNR1B | |
| SCHEMBL23218733 | 0.74 | LIPG (0.39) | EGFRLPLLIPGROCK1CA12 | |
| SCHEMBL29591450 | 0.74 | LIPG (0.39) | EGFRLPLLIPGROCK1CA12 | |
| SCHEMBL20082781 | 0.71 | MAPT (0.41) | TP53MAPTSMN1; SMN2CA12CA1 | |
| SCHEMBL12100235 | 0.68 | LPL (0.41) | EGFRLPLLIPGCA12CA1 | |
| SCHEMBL13726620 | 0.67 | EGFR (0.46) | EGFRLPLLIPGCA12CA1 | |
| SCHEMBL15897075 | 0.66 | MEN1 (0.42) | ROCK1MTNR1ATP53MAPTSMN1; SMN2 | |
| SCHEMBL29611909 | 0.65 | PSMB5 (0.44) | CA2 |
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-2021213358-A1 | BORON-CONTAINING COMPOUNDS AND APPLICATION THEREOF | 江苏先声药业有限公司 (CN) | 2021-10-28 | — | — | WO | disclosed |