Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.47 |
| ▸ | TNKS | O95271 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.47 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.38 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.36 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12553330 | 0.80 | APP (0.47) | NPC1RAB9AEGFR | |
| SCHEMBL13811309 | 0.80 | NPC1 (0.59) | TNKSNPC1RAB9ANOTUMTHRB | |
| SCHEMBL13990267 | 0.79 | CSNK2A2 (0.47) | TNKSPARP1TNKS2PARP2NPC1 | |
| SCHEMBL13990266 | 0.76 | GABRP (0.47) | TNKSPARP1TNKS2NPC1RAB9A | |
| SCHEMBL30482423 | 0.76 | ESR1 (0.56) | TNKSNPC1RAB9ALMNACSNK2A2 | |
| SCHEMBL347966 | 0.75 | MAOB (0.53) | TNKSPARP1TNKS2NPC1RAB9A | |
| SCHEMBL28679982 | 0.74 | NOTUM (0.41) | PARP1PARP2NPC1RAB9ANOTUM | |
| SCHEMBL13990268 | 0.73 | EGFR (0.65) | TNKSNPC1RAB9ALMNATHRB | |
| SCHEMBL28668346 | 0.73 | APP (0.50) | TNKSRAB9ANOTUM | |
| SCHEMBL14407359 | 0.72 | TNKS (0.50) | HDAC6TNKSPARP1TNKS2PARP2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113861137-B | Method for synthesizing furan compound by one-step reaction of ketone and alpha chloroketone | 重庆医科大学 | 2023-08-15 | — | — | CN | disclosed |
| CN-113861137-A | Method for synthesizing furan compound by one-step reaction of ketone and alpha chloroketone | 重庆医科大学 | 2021-12-31 | — | — | CN | disclosed |