Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL395548 | 0.96 | CYP3A4 (0.35) | CYP3A4TSHRMAPK1 | |
| SCHEMBL28823633 | 0.90 | CYP3A4 (0.32) | CYP3A4TSHRMAPK1 | |
| SCHEMBL3340604 | 0.76 | CD44 (0.35) | CYP3A4 | |
| SCHEMBL3922962 | 0.76 | CYP3A4 (0.33) | CYP3A4TSHRMAPK1 | |
| SCHEMBL27577169 | 0.72 | POLB (0.31) | — | |
| SCHEMBL8079422 | 0.69 | — | — | |
| SCHEMBL39444 | 0.66 | TSHR (0.57) | CYP3A4TSHRMAPK1 | |
| SCHEMBL27887332 | 0.65 | CYP1A2 (0.30) | — | |
| SCHEMBL28040427 | 0.63 | RAPGEF4 (0.32) | — | |
| SCHEMBL25403085 | 0.62 | TSHR (0.53) | CYP3A4TSHRMAPK1 |
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 |