Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 9/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL12682497 | 0.86 | NPBWR1 (0.48) | KDM1AALOX5PTGS2PTGS1 | |
| SCHEMBL27915408 | 0.84 | KDM1A (0.53) | KDM1AALOX5PTGS2PTGS1 | |
| SCHEMBL12682508 | 0.84 | TSHR (0.47) | — | |
| SCHEMBL28019204 | 0.83 | ADORA2A (0.43) | — | |
| SCHEMBL29371576 | 0.83 | ADORA2A (0.66) | KDM1A | |
| SCHEMBL6001161 | 0.79 | KDM1A (0.58) | KDM1A | |
| SCHEMBL30537037 | 0.78 | NUDT1 (0.61) | — | |
| SCHEMBL729919 | 0.78 | NUDT1 (0.61) | — | |
| SCHEMBL15595212 | 0.78 | TDP1 (0.69) | — | |
| Iodide SCHEMBL31032485 | 0.77 | NUDT1 (0.59) | — |
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-107602620-B | Novel iridium-based complexes for ECL | 霍夫曼-拉罗奇有限公司 | 2020-08-28 | — | — | CN | disclosed |