Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8397304 | 0.79 | NPC1 (0.31) | — | |
| SCHEMBL5084054 | 0.76 | CYP1A2 (0.37) | CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL18071854 | 0.74 | CYP1A2 (0.35) | CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL7082904 | 0.74 | NPC1 (0.36) | — | |
| SCHEMBL15915030 | 0.73 | — | — | |
| SCHEMBL15915185 | 0.72 | — | — | |
| SCHEMBL26091815 | 0.70 | — | — | |
| SCHEMBL5079592 | 0.69 | — | — | |
| SCHEMBL6227576 | 0.66 | CYP1A2 (0.30) | CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL6226977 | 0.66 | CYP1A2 (0.30) | CYP1A2CYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-7393965-B2 | Crosslinked metallocene compound for olefin polymerization and method of polymerizing olefin with the same | MITSUI CHEMICALS, INC. (JP) | 2008-07-01 | — | — | US | disclosed |