Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.56 |
| ▸ | CES2 | O00748 | 1/20 | 0.53 |
| ▸ | CES1 | P23141 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | ENPP3 | O14638 | 2/20 | 0.48 |
| ▸ | ALPL | P05186 | 2/20 | 0.48 |
| ▸ | XIAP | P98170 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL11633454 | 0.83 | CA9 (0.50) | BCHEHPGDRAB9ANPC1LMNA | |
| SCHEMBL28723318 | 0.81 | CES2 (0.47) | BCHECES2CES1TSHRHPGD | |
| SCHEMBL29612347 | 0.81 | CES2 (0.47) | BCHECES2CES1TSHRHPGD | |
| SCHEMBL1207022 | 0.79 | NPC1 (0.47) | BCHERAB9ANPC1ENPP3ALPL | |
| SCHEMBL11577852 | 0.79 | BCHE (0.56) | BCHECES2CES1TSHRHPGD | |
| SCHEMBL9686147 | 0.77 | P2RX4 (0.55) | BCHETSHRRAB9ANPC1LMNA | |
| SCHEMBL31047662 | 0.77 | P2RX4 (0.55) | BCHETSHRRAB9ANPC1LMNA | |
| SCHEMBL31047657 | 0.77 | BCHE (0.56) | BCHECES2CES1HPGDRAB9A | |
| SCHEMBL29236557 | 0.76 | GSK3B (0.63) | CES2CES1HPGDRAB9ANPC1 | |
| SCHEMBL11576538 | 0.75 | P2RX4 (0.54) | CES2CES1LMNAMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-118496146-A | Preparation method of isoindoline diketone compound | 五邑大学 | 2024-08-16 | — | — | CN | disclosed |