Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 12/20 | 0.52 |
| ▸ | CTSK | P43235 | 4/20 | 0.52 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | SOS1 | Q07889 | 2/20 | 0.33 |
| ▸ | ATR | Q13535 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24981840 | 1.00 | CTSC (0.52) | CTSCCTSKALKHDAC1SOS1 | |
| SCHEMBL28989665 | 0.81 | CTSC (0.51) | CTSCCTSK | |
| SCHEMBL28989663 | 0.81 | CTSC (0.52) | CTSCCTSKHDAC1HDAC6 | |
| SCHEMBL24981838 | 0.80 | CTSC (0.59) | CTSCCTSK | |
| SCHEMBL17483511 | 0.76 | CTSC (0.49) | CTSCCTSKALK | |
| SCHEMBL20384133 | 0.74 | CTSC (0.91) | CTSCCTSK | |
| SCHEMBL29455624 | 0.74 | CTSC (0.55) | CTSCCTSK | |
| SCHEMBL25146659 | 0.74 | CTSC (0.62) | CTSCCTSK | |
| SCHEMBL24981825 | 0.74 | CTSC (0.62) | CTSCCTSK | |
| SCHEMBL28989325 | 0.74 | CTSC (0.62) | CTSCCTSK |
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-115996923-A | Nitrile derivative as dipeptidyl peptidase 1 inhibitor and application thereof | 四川海思科制药有限公司 | 2023-04-21 | — | — | CN | disclosed |