Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 16/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 16/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.42 |
| ▸ | CDC42 | P60953 | 1/20 | 0.42 |
| ▸ | RAC1 | P63000 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9686535 | 0.99 | AKR1C3 (0.43) | AKR1C3AKR1C2PTGS2PTGS1CDC42 | |
| SCHEMBL29217933 | 0.97 | AKR1C3 (0.42) | AKR1C3AKR1C2PTGS2PTGS1CDC42 | |
| SCHEMBL17167376 | 0.87 | AKR1C3 (0.41) | AKR1C3AKR1C2PTGS2PTGS1CDC42 | |
| SCHEMBL17167385 | 0.86 | AKR1C3 (0.45) | AKR1C3AKR1C2PTGS2PTGS1CDC42 | |
| Imidazole SCHEMBL29217935 | 0.86 | AKR1C3 (0.36) | AKR1C3AKR1C2PTGS2PTGS1CDC42 | |
| SCHEMBL29217934 | 0.84 | LMNA (0.46) | AKR1C3AKR1C2PTGS2PTGS1TSHR | |
| SCHEMBL10469262 | 0.79 | PTGS2 (0.46) | AKR1C3AKR1C2PTGS2PTGS1CDC42 | |
| SCHEMBL23343275 | 0.79 | DRD2 (0.36) | TSHR | |
| SCHEMBL29077435 | 0.77 | PTGS1 (0.60) | AKR1C3AKR1C2PTGS2PTGS1CDC42 | |
| SCHEMBL9688424 | 0.76 | POLB (0.40) | — |
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-118063657-A | Preparation method of antibacterial cell proliferation-promoting metal complex ion polymer | 常州大学 | 2024-05-24 | — | — | CN | claimed |