Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 16/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL904009 | 0.83 | SLC6A2 (0.45) | KIF11PTGS2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL903872 | 0.82 | KIF11 (0.40) | KIF11PTGS2PTGS1 | |
| SCHEMBL903948 | 0.82 | SLC9A3 (0.43) | PTGS2PTGS1 | |
| SCHEMBL904168 | 0.80 | PTGS2 (0.39) | KIF11PTGS2PTGS1SLC6A2SLC6A4 | |
| SCHEMBL720234 | 0.78 | KIF11 (0.44) | KIF11PTGS2PTGS1 | |
| SCHEMBL718908 | 0.78 | PTGS2 (0.46) | KIF11PTGS2PTGS1 | |
| SCHEMBL720365 | 0.78 | KIF11 (0.44) | KIF11PTGS2PTGS1 | |
| SCHEMBL10067419 | 0.78 | SLC6A2 (0.43) | KIF11SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL721461 | 0.76 | PTGS1 (0.44) | KIF11PTGS2PTGS1 | |
| SCHEMBL903884 | 0.75 | KIF11 (0.41) | KIF11PTGS2PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012041158-A1 | TRICYCLIC COMPOUND, PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF | 上海恒瑞医药有限公司 (CN) | 2012-04-05 | — | — | WO | disclosed |