Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | PYGL | P06737 | 6/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.32 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.31 |
| ▸ | TMPRSS15 | P98073 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25564753 | 0.95 | DPP4 (0.38) | PKMCNR1CNR2PYGLCA2 | |
| SCHEMBL19083910 | 0.81 | ALDH1A1 (0.37) | CNR1CNR2PYGLCA2PRSS1 | |
| SCHEMBL19075636 | 0.81 | ALDH1A1 (0.37) | CNR1CNR2PYGLCA2PRSS1 | |
| SCHEMBL25421475 | 0.78 | — | — | |
| SCHEMBL25239215 | 0.77 | BTK (0.43) | PKMCA2 | |
| SCHEMBL3416246 | 0.76 | MMP1 (0.49) | PDK1PDK2PDK3PDK4 | |
| SCHEMBL25564751 | 0.76 | TP53 (0.42) | CA2PDK1PDK2PDK3PDK4 | |
| SCHEMBL25755234 | 0.76 | CA2 (0.47) | PKMCA2PDK1PDK2PDK3 | |
| SCHEMBL8283711 | 0.75 | PDK1 (0.34) | PKMCA2DPP4PDK1PDK2 | |
| SCHEMBL19083902 | 0.75 | SMN1; SMN2 (0.37) | PYGLCA2 |
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-2023023631-A1 | INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF | Pardes Biosciences, Inc. (US) | 2023-02-23 | — | — | WO | disclosed |