Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL28040409 | 0.82 | — | — | |
| SCHEMBL10320254 | 0.78 | CYP3A4 (0.32) | CYP3A4TSHRMAPK1 | |
| SCHEMBL10319143 | 0.73 | PGK1 (0.30) | — | |
| SCHEMBL4246204 | 0.73 | CYP3A4 (0.35) | CYP3A4TSHRMAPK1 | |
| SCHEMBL28040615 | 0.73 | CYP1A2 (0.33) | TSHR | |
| SCHEMBL28040387 | 0.69 | RAPGEF4 (0.41) | TSHR | |
| SCHEMBL28040372 | 0.69 | CA1 (0.30) | — | |
| SCHEMBL120101 | 0.68 | TSHR (0.39) | CYP3A4TSHRMAPK1 | |
| SCHEMBL30010076 | 0.67 | CYP3A4 (0.33) | CYP3A4TSHRMAPK1 | |
| SCHEMBL10318145 | 0.67 | — | — |
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-102666561-B | Transition metal complex, the cyclopentadiene compound of catalyst for trimerization and replacement | SUMITOMO CHEMICAL CO.,LTD. (JP) | 2015-11-25 | — | — | CN | disclosed |