Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 10/20 | 0.52 |
| ▸ | CTSS | P25774 | 7/20 | 0.52 |
| ▸ | MMP1 | P03956 | 1/20 | 0.49 |
| ▸ | MMP3 | P08254 | 1/20 | 0.49 |
| ▸ | MMP9 | P14780 | 1/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.47 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | JAK3 | P52333 | 1/20 | 0.43 |
| ▸ | BTK | Q06187 | 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 | |
|---|---|---|---|---|
| SCHEMBL29178324 | 1.00 | CTSK (0.52) | CTSKCTSSMMP1MMP3MMP9 | |
| SCHEMBL30049273 | 1.00 | CTSK (0.52) | CTSKCTSSMMP1MMP3MMP9 | |
| SCHEMBL29178423 | 0.84 | MMP3 (0.64) | CTSKCTSSMMP1MMP3MMP9 | |
| SCHEMBL24814567 | 0.84 | MMP3 (0.64) | CTSKCTSSMMP1MMP3MMP9 | |
| SCHEMBL25139423 | 0.83 | MMP1 (0.45) | MMP1MMP3MMP9 | |
| SCHEMBL6550878 | 0.82 | CTSS (0.74) | CTSKCTSSMMP1MMP3MMP9 | |
| SCHEMBL13669553 | 0.82 | CTSS (0.74) | CTSKCTSSMMP1MMP3MMP9 | |
| SCHEMBL12890034 | 0.82 | CTSS (0.74) | CTSKCTSSMMP1MMP3MMP9 | |
| SCHEMBL25139698 | 0.81 | CTSK (0.54) | CTSKCTSSMMP1MMP3MMP9 | |
| SCHEMBL29178351 | 0.81 | CTSK (0.54) | CTSKCTSSMMP1MMP3MMP9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022272106-A1 | CDK2 INHIBITORS AND METHODS OF USING THE SAME | CEDILLA THERAPEUTICS, INC. (US) | 2022-12-29 | — | — | WO | disclosed |