Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCGR | P47871 | 2/20 | 0.52 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.52 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4793206 | 0.82 | GCGR (0.65) | GCGRMAPK14 | |
| Piperazine SCHEMBL28060957 | 0.74 | GCGR (0.56) | GCGRMAPK14 | |
| SCHEMBL28552564 | 0.72 | GCGR (0.61) | GCGRMAPK14 | |
| SCHEMBL28542916 | 0.72 | GCGR (0.61) | GCGRMAPK14 | |
| SCHEMBL28154907 | 0.72 | GCGR (0.61) | GCGRMAPK14 | |
| SCHEMBL28912040 | 0.72 | GCGR (0.82) | GCGRMAPK14 | |
| SCHEMBL4778800 | 0.72 | GCGR (0.51) | GCGRMAPK14 | |
| SCHEMBL8987160 | 0.72 | CYP2E1 (0.53) | CYP2E1CYP2A6CYP2B6 | |
| SCHEMBL7058734 | 0.72 | CYP2A6 (0.70) | CYP2E1CYP2A6CYP2B6 | |
| SCHEMBL27870289 | 0.70 | CYP2A6 (0.67) | CYP2E1CYP2A6CYP2B6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108863890-B | 4-pyrroline-2-ketone derivative and preparation method thereof | 厦门华厦学院 | 2021-04-20 | — | — | CN | disclosed |
| CN-108863890-A | A kind of 4- pyrroline-2-one derivative and preparation method thereof | 厦门华厦学院 | 2018-11-23 | — | — | CN | disclosed |