Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9903674 | 1.00 | ALDH1A1 (0.31) | ALDH1A1TSHRCES2CES1 | |
| SCHEMBL3643419 | 0.94 | TSHR (0.35) | ALDH1A1TSHRCES2CES1 | |
| SCHEMBL3643422 | 0.94 | TSHR (0.35) | ALDH1A1TSHRCES2CES1 | |
| SCHEMBL1685573 | 0.89 | TSHR (0.38) | ALDH1A1TSHRCES2CES1 | |
| SCHEMBL1685601 | 0.89 | — | — | |
| SCHEMBL1685600 | 0.89 | — | — | |
| SCHEMBL3642051 | 0.89 | — | — | |
| SCHEMBL11463038 | 0.85 | TSHR (0.40) | ALDH1A1TSHRCES2CES1 | |
| SCHEMBL11463039 | 0.85 | TSHR (0.40) | ALDH1A1TSHRCES2CES1 | |
| SCHEMBL9378907 | 0.84 | TSHR (0.32) | TSHRCES2CES1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2307468-B1 | TYRE AND CROSSLINKABLE ELASTOMERIC COMPOSITION COMPRISING AN ISOTACTIC COPOLYMER OBTAINED BY HOMOGENOUS CATALYSIS | PIRELLI (IT) | 2012-06-13 | — | — | EP | disclosed |