Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNLIP | P16233 | 2/20 | 0.61 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.54 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.54 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | ESRRB | O95718 | 1/20 | 0.51 |
| ▸ | ESR1 | P03372 | 1/20 | 0.51 |
| ▸ | ESRRA | P11474 | 1/20 | 0.51 |
| ▸ | ESRRG | P62508 | 1/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.51 |
| ▸ | STK17B | O94768 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 3/20 | 0.46 |
| ▸ | PPARD | Q03181 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29255381 | 0.92 | PNLIP (0.55) | PNLIPCSNK2A2CSNK2BCSNK2A1MEN1 | |
| SCHEMBL29254663 | 0.92 | PNLIP (0.56) | PNLIPCSNK2A2CSNK2BCSNK2A1MEN1 | |
| SCHEMBL29254650 | 0.91 | MAOB (0.59) | PNLIPCSNK2A2CSNK2BCSNK2A1MEN1 | |
| SCHEMBL29254651 | 0.91 | ESRRB (0.57) | PNLIPCSNK2A2CSNK2BCSNK2A1MEN1 | |
| SCHEMBL29255095 | 0.90 | MAOB (0.60) | PNLIPCSNK2A2CSNK2BCSNK2A1MEN1 | |
| SCHEMBL29254646 | 0.87 | ACHE (0.55) | MAOB | |
| SCHEMBL29254643 | 0.87 | PNLIP (0.51) | PNLIPCSNK2A2CSNK2BCSNK2A1MEN1 | |
| SCHEMBL29254664 | 0.86 | MEN1 (0.61) | PNLIPCSNK2A2CSNK2BCSNK2A1MEN1 | |
| SCHEMBL29254648 | 0.86 | ESRRA (0.57) | PNLIPCSNK2A2CSNK2BCSNK2A1MEN1 | |
| SCHEMBL29254644 | 0.85 | CXCL12 (0.59) | PNLIPCSNK2A2CSNK2BCSNK2A1MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024146619-A1 | AURONE DERIVATIVE OR ANALOG, AND PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF | 中国科学院上海药物研究所 | 2024-07-11 | — | — | WO | disclosed |
| CN-118307504-A | Orange ketone derivative or analogue, preparation method, pharmaceutical composition and application thereof | 中国科学院上海药物研究所 | 2024-07-09 | — | — | CN | disclosed |