Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
| ▸ | CHAT | P28329 | 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 | |
|---|---|---|---|---|
| SCHEMBL8972699 | 0.81 | CHAT (0.42) | ALDH1A1MAOBRELATRPA1NFE2L2 | |
| SCHEMBL8972692 | 0.81 | CHAT (0.42) | ALDH1A1MAOBRELATRPA1NFE2L2 | |
| SCHEMBL13837633 | 0.79 | CYP1A2 (0.31) | ALDH1A1TSHRMAOBCYP2A6LMNA | |
| SCHEMBL2437428 | 0.78 | — | — | |
| SCHEMBL11367090 | 0.76 | — | — | |
| SCHEMBL9224606 | 0.72 | ALDH1A1 (0.34) | ALDH1A1CYP2A6LMNA | |
| SCHEMBL2459360 | 0.72 | — | — | |
| SCHEMBL8854148 | 0.70 | GSK3B (0.38) | ALDH1A1TSHR | |
| SCHEMBL13712853 | 0.69 | HSP90AA1 (0.30) | — | |
| SCHEMBL8165654 | 0.69 | ALDH1A1 (0.31) | ALDH1A1TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0750625-B1 | PREPARATION OF MONOCYCLOPENTADIENYL METAL COMPLEXES BY NUCLEOPHILIC SUBSTITUTION OF BIS(CYCLOPENTADIENYL) METAL COMPLEXES | DOW CHEMICAL CO (US) | 1999-02-03 | — | — | EP | claimed |
| EP-0955304-A2 | Bridged metallocene complex for the (co)polymerization of olefins | Enichem S.p.A. (IT) | 1999-11-10 | — | — | EP | disclosed |