Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 13/20 | 0.48 |
| ▸ | CTSS | P25774 | 10/20 | 0.43 |
| ▸ | CTSL | P07711 | 3/20 | 0.41 |
| ▸ | CTSB | P07858 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29178395 | 1.00 | CTSK (0.48) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL24815288 | 1.00 | CTSK (0.48) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL29178308 | 0.85 | CTSK (0.44) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL24812376 | 0.85 | CTSK (0.44) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL30047908 | 0.79 | CTSK (0.45) | CTSKCTSSCTSLCTSB | |
| SCHEMBL29178408 | 0.79 | CTSK (0.45) | CTSKCTSSCTSLCTSB | |
| SCHEMBL16255614 | 0.78 | CTSK (0.65) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL24815320 | 0.78 | CTSK (0.65) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL14984662 | 0.78 | CTSK (0.49) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL12668952 | 0.78 | CTSK (0.49) | CTSKCTSSCTSLCTSBCA1 |
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-117561058-A | CDK2 inhibitors and methods of use thereof | 塞迪拉治疗股份有限公司 | 2024-02-13 | — | — | CN | disclosed |