Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 15/20 | 0.54 |
| ▸ | ERN1 | O75460 | 2/20 | 0.50 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | VRK2 | Q86Y07 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL386673 | 0.84 | KIF11 (0.61) | KIF11PTGS2ENPP2PTGS1 | |
| SCHEMBL904021 | 0.82 | KIF11 (0.57) | KIF11PTGS2ERN1VRK2 | |
| SCHEMBL806770 | 0.80 | ENPP2 (0.44) | KIF11PTGS2ENPP2 | |
| SCHEMBL10067772 | 0.79 | PTGS2 (0.57) | KIF11PTGS2ERN1 | |
| SCHEMBL7677302 | 0.77 | PTGS2 (0.62) | KIF11PTGS2ENPP2PTGS1 | |
| SCHEMBL10300269 | 0.77 | PTGS2 (0.62) | KIF11PTGS2ENPP2PTGS1 | |
| SCHEMBL903956 | 0.76 | ENPP2 (0.53) | KIF11PTGS2ENPP2 | |
| SCHEMBL722526 | 0.76 | KIF11 (0.56) | KIF11PTGS2 | |
| SCHEMBL7395459 | 0.76 | PTGS2 (0.74) | PTGS2PTGS1 | |
| SCHEMBL6470141 | 0.76 | PTGS2 (0.74) | PTGS2PTGS1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102639500-B | Tricyclic compound, preparation method and pharmaceutical use thereof | SHANGHAI HENGRUI PHARM CO LTD | 2015-02-11 | — | — | CN | disclosed |
| CN-102639500-A | Tricyclic compound, preparation method and pharmaceutical use thereof | SHANGHAI HENGRUI PHARM CO LTD | 2012-08-15 | — | — | CN | disclosed |
| 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 |