Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.38 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | PYGL | P06737 | 6/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.35 |
| ▸ | TMPRSS15 | P98073 | 2/20 | 0.35 |
| ▸ | MMP2 | P08253 | 3/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | MMP7 | P09237 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL25076151 | 0.95 | PKM (0.35) | DPP4PDK1PDK2PDK3PDK4 | |
| SCHEMBL25564751 | 0.81 | TP53 (0.42) | PDK1PDK2PDK3PDK4MMP2 | |
| SCHEMBL3416246 | 0.81 | MMP1 (0.49) | PDK1PDK2PDK3PDK4MMP2 | |
| SCHEMBL8283711 | 0.80 | PDK1 (0.34) | DPP4PDK1PDK2PDK3PDK4 | |
| SCHEMBL14074440 | 0.79 | PDK1 (0.33) | DPP4PDK1PDK2PDK3PDK4 | |
| SCHEMBL9171597 | 0.79 | PYGL (0.41) | DPP4CNR1CNR2PYGLMMP2 | |
| SCHEMBL25421475 | 0.77 | — | — | |
| SCHEMBL31203641 | 0.77 | PYGL (0.35) | PDK1PDK2PDK3PDK4CNR1 | |
| SCHEMBL3107097 | 0.76 | CA12 (0.54) | PDK1PDK2PDK3PDK4CNR2 | |
| SCHEMBL19075636 | 0.76 | ALDH1A1 (0.37) | CNR1CNR2PYGLPRSS1TMPRSS15 |
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-2023093834-A1 | PYRROLIDINE ANTIVIRAL COMPOUND | 先声再明医药有限公司 | 2023-06-01 | — | — | WO | disclosed |