Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.75 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 9/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 4/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20508881 | 0.87 | ALDH1A1 (0.82) | ALDH1A1LMNATDP1CYP3A4TSHR | |
| SCHEMBL8420801 | 0.87 | — | — | |
| SCHEMBL16324 | 0.87 | — | — | |
| SCHEMBL9492501 | 0.87 | — | — | |
| SCHEMBL6249719 | 0.87 | ALDH1A1 (1.00) | ALDH1A1LMNATDP1CYP3A4TSHR | |
| SCHEMBL23087843 | 0.84 | ALDH1A1 (0.95) | ALDH1A1LMNATDP1CYP3A4TSHR | |
| SCHEMBL6712852 | 0.84 | ALDH1A1 (0.95) | ALDH1A1LMNATDP1CYP3A4TSHR | |
| SCHEMBL7199575 | 0.84 | ALDH1A1 (0.95) | ALDH1A1LMNATDP1CYP3A4TSHR | |
| SCHEMBL22664580 | 0.84 | ALDH1A1 (0.95) | ALDH1A1LMNATDP1CYP3A4TSHR | |
| Butane SCHEMBL21384927 | 0.84 | ALDH1A1 (0.95) | ALDH1A1LMNATDP1CYP3A4TSHR |
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-1899061-B1 | NOVEL ZIRCONIUM COMPOUND, CATALYST AND ITS USE FOR POLYURETHANE MANUFACTURE | DORF KETAL CHEMICALS INDIA PRIVATE LTD (IN) | 2014-08-13 | — | — | EP | disclosed |