Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 14/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23202777 | 1.00 | ABCB1 (0.58) | ABCB1CYP3A4MAPK1STING1PTGS1 | |
| SCHEMBL23202784 | 0.96 | ABCB1 (0.52) | ABCB1CYP3A4MAPK1STING1PTGS1 | |
| SCHEMBL30350408 | 0.96 | ABCB1 (0.52) | ABCB1CYP3A4MAPK1STING1PTGS1 | |
| SCHEMBL23202739 | 0.93 | ABCB1 (0.48) | ABCB1CYP3A4MAPK1STING1PTGS1 | |
| SCHEMBL30350409 | 0.93 | ABCB1 (0.48) | ABCB1CYP3A4MAPK1STING1PTGS1 | |
| SCHEMBL5839485 | 0.92 | ABCB1 (0.68) | ABCB1CYP3A4MAPK1STING1 | |
| SCHEMBL23202736 | 0.92 | PTGS1 (0.49) | ABCB1CYP3A4MAPK1STING1PTGS1 | |
| SCHEMBL30350345 | 0.92 | PTGS1 (0.49) | ABCB1CYP3A4MAPK1STING1PTGS1 | |
| SCHEMBL24983863 | 0.92 | ABCB1 (0.61) | ABCB1CYP3A4MAPK1STING1PTGS1 | |
| SCHEMBL30141115 | 0.92 | ABCB1 (0.61) | ABCB1CYP3A4MAPK1STING1PTGS1 |
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-110183431-B | Compound for treating or preventing liver diseases | 江苏新元素医药科技有限公司 | 2023-04-11 | — | — | CN | disclosed |