Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.53 |
| ▸ | PRF1 | P14222 | 1/20 | 0.48 |
| ▸ | PTPRC | P08575 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.45 |
| ▸ | CA9 | Q16790 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | XDH | P47989 | 1/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 2/20 | 0.44 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.44 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.44 |
| ▸ | PIM1 | P11309 | 1/20 | 0.44 |
| ▸ | FLT3 | P36888 | 1/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4611577 | 1.00 | SMYD3 (0.53) | SMYD3PRF1PTPRCCA12CA9 | |
| SCHEMBL19474641 | 0.88 | CLK4 (0.46) | PTPRCCA12CA9CA1CA2 | |
| SCHEMBL30450993 | 0.88 | CLK4 (0.46) | PTPRCCA12CA9CA1CA2 | |
| SCHEMBL30336933 | 0.85 | PRKACA (0.58) | PTPRCKMT2AGSK3BGRM5PARP1 | |
| SCHEMBL12683051 | 0.85 | PRKACA (0.58) | PTPRCKMT2AGSK3BGRM5PARP1 | |
| SCHEMBL24502882 | 0.84 | DAPK3 (0.41) | SMYD3PRF1PTPRCKMT2ACTDSP1 | |
| SCHEMBL22169855 | 0.83 | L3MBTL1 (0.45) | SMYD3PRF1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL14683952 | 0.82 | NPC1 (0.58) | SMYD3PRF1CA12CA9KMT2A | |
| SCHEMBL15759502 | 0.81 | SMYD3 (0.60) | SMYD3PRF1CA12CA9GSK3B | |
| SCHEMBL14332678 | 0.80 | SMYD3 (0.58) | SMYD3PRF1PTPRCCA12CA9 |
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-113563245-B | Substituted pyrrolidines and their use in medicine | 广东东阳光药业股份有限公司 | 2024-10-15 | — | — | CN | disclosed |