Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 2/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 5/20 | 0.46 |
| ▸ | REN | P00797 | 1/20 | 0.46 |
| ▸ | CTSD | P07339 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4523139 | 0.91 | CNR2 (0.51) | HDAC3HDAC4HDAC1HDAC2HDAC8 | |
| SCHEMBL4522530 | 0.91 | CNR2 (0.51) | HDAC3HDAC4HDAC1HDAC2HDAC8 | |
| SCHEMBL22626791 | 0.87 | TRPA1 (0.54) | NPC1RAB9ABACE1BCHESLC6A11 | |
| SCHEMBL9012913 | 0.85 | BACE1 (0.50) | NPC1RAB9ABACE1BCHESLC6A11 | |
| SCHEMBL4522709 | 0.84 | CCR1 (0.49) | NPC1RAB9ABACE1BCHESLC6A11 | |
| SCHEMBL4522714 | 0.84 | CCR1 (0.49) | NPC1RAB9ABACE1BCHESLC6A11 | |
| SCHEMBL7607271 | 0.82 | BACE1 (0.55) | BACE1BCHESLC6A11 | |
| SCHEMBL7607276 | 0.82 | BACE1 (0.55) | BACE1BCHESLC6A11 | |
| SCHEMBL7306846 | 0.81 | BACE1 (0.60) | BACE1BCHESLC6A11 | |
| SCHEMBL10707926 | 0.81 | BACE1 (0.47) | NPC1RAB9ABACE1BCHESLC6A11 |
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-3795572-B1 | DARUNAVIR PROPIONATE SOLVATE | LAURUS LABS LTD (IN) | 2023-11-15 | — | — | EP | disclosed |