Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL2 | P10415 | 6/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | CACNA1B | Q00975 | 4/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | PPARA | Q07869 | 1/20 | 0.34 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.34 |
| ▸ | GSTM2 | P28161 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.33 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.33 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18428045 | 1.00 | BCL2 (0.37) | BCL2MCL1CACNA1BSYKPPARG | |
| SCHEMBL18428044 | 1.00 | BCL2 (0.37) | BCL2MCL1CACNA1BSYKPPARG | |
| SCHEMBL16974998 | 1.00 | BCL2 (0.37) | BCL2MCL1CACNA1BSYKPPARG | |
| SCHEMBL16974997 | 1.00 | BCL2 (0.37) | BCL2MCL1CACNA1BSYKPPARG | |
| SCHEMBL16970779 | 0.93 | CACNA1B (0.37) | BCL2MCL1CACNA1BSYKPPARG | |
| SCHEMBL28907023 | 0.93 | CACNA1B (0.37) | BCL2MCL1CACNA1BSYKPPARG | |
| SCHEMBL18428013 | 0.88 | BCL2 (0.37) | BCL2MCL1PPARGPPARAGSTP1 | |
| SCHEMBL18428014 | 0.88 | BCL2 (0.37) | BCL2MCL1PPARGPPARAGSTP1 | |
| SCHEMBL18428110 | 0.87 | SYK (0.39) | CACNA1BSYKPPARAATMKLK5 | |
| SCHEMBL16970781 | 0.86 | BCL2 (0.36) | BCL2MCL1CACNA1BPPARGPPARA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3102195-B1 | BETA-SUBSTITUTED BETA-AMINO ACIDS AND ANALOGS AS CHEMOTHERAPEUTIC AGENTS | QUADRIGA BIOSCIENCES INC (US) | 2021-10-06 | — | — | EP | disclosed |