Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 16/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| SCHEMBL903872 | 0.84 | KIF11 (0.40) | KIF11PTGS2PTGS1DRD1BRD4 | |
| SCHEMBL10068053 | 0.81 | HRH3 (0.39) | KIF11PTGS2PTGS1BRD4 | |
| SCHEMBL903936 | 0.77 | GPR119 (0.48) | — | |
| SCHEMBL10067699 | 0.77 | NR1H2 (0.40) | KIF11PTGS2PTGS1 | |
| SCHEMBL10068048 | 0.77 | CHRNB2 (0.47) | KIF11PTGS2PTGS1BRD4 | |
| SCHEMBL904082 | 0.76 | GPR119 (0.47) | PTGS2 | |
| SCHEMBL903891 | 0.76 | GPR119 (0.47) | PTGS2 | |
| SCHEMBL903962 | 0.76 | TBK1 (0.41) | BRD4 | |
| SCHEMBL10068069 | 0.75 | GPR119 (0.45) | PTGS2 | |
| SCHEMBL10067702 | 0.75 | GPR119 (0.45) | PTGS2 |
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 |