Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP30 | Q70CQ3 | 4/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL29270508 | 0.90 | USP30 (0.36) | USP30PDK2BACE1BACE2 | |
| SCHEMBL26961445 | 0.89 | USP30 (0.34) | USP30KCNH2MCHR1BACE1BACE2 | |
| SCHEMBL29270712 | 0.82 | GRM2 (0.33) | KCNH2MCHR1PDK2BACE1BACE2 | |
| SCHEMBL29270657 | 0.82 | PDK2 (0.32) | PDK2BACE1BACE2 | |
| SCHEMBL29270650 | 0.80 | ALOX5 (0.32) | KCNH2MCHR1PDK2BACE1BACE2 | |
| SCHEMBL26961463 | 0.79 | USP30 (0.35) | USP30BACE1BACE2 | |
| SCHEMBL29270632 | 0.78 | NPC1 (0.44) | BACE1BACE2KMT2A | |
| SCHEMBL29270473 | 0.78 | KMT2A (0.42) | BACE1BACE2KMT2A | |
| SCHEMBL29270639 | 0.77 | KDM4E (0.38) | BACE1BACE2 | |
| SCHEMBL29270587 | 0.77 | HPGD (0.40) | BACE1BACE2 |
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-116964048-A | Bicyclic tetrahydroazepine derivatives for the treatment of cancer | 豪夫迈·罗氏有限公司 | 2023-10-27 | — | — | CN | disclosed |