Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BIRC5 | O15392 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 3/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.30 |
| ▸ | TRAP1 | Q12931 | 2/20 | 0.30 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.30 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6064252 | 0.89 | HSP90AA1 (0.33) | HSP90AA1TRAP1HSP90AB1HSP90B1 | |
| SCHEMBL5602850 | 0.83 | BIRC5 (0.34) | BIRC5MAOA | |
| SCHEMBL5600473 | 0.80 | BIRC5 (0.35) | BIRC5KDM1AMAOA | |
| SCHEMBL5603210 | 0.76 | MAOA (0.42) | KDM1AMAOA | |
| SCHEMBL5601814 | 0.76 | ALDH1A1 (0.41) | KDM1AMAOA | |
| SCHEMBL6064840 | 0.74 | HSP90AA1 (0.31) | HSP90AA1 | |
| SCHEMBL831356 | 0.74 | HSP90AA1 (0.39) | BIRC5HSP90AA1TRAP1HSP90AB1HSP90B1 | |
| SCHEMBL5603800 | 0.73 | BCHE (0.37) | KDM1AMAOA | |
| Hydrochloric Acid SCHEMBL5601020 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL5601185 | 0.69 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7276567-B2 | Heterocyclic substituted metallocene compounds for olefin polymerization | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2007-10-02 | — | — | US | disclosed |
| EP-1735354-A1 | HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | Exxonmobil Chemical Company Inc. (US) | 2006-12-27 | — | — | EP | disclosed |
| US-20050261449-A1 | Heterocyclic substituted metallocene compounds for olefin polymerization | EXXONMOBIL CHEMICAL PATENT INC. | 2005-11-24 | — | — | US | disclosed |
| WO-2005105864-A1 | HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2005-11-10 | — | — | WO | disclosed |