Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL7379533 | 0.78 | — | — | |
| SCHEMBL614455 | 0.78 | — | — | |
| SCHEMBL13917479 | 0.76 | CES2 (0.39) | ALDH1A1TSHRHTT | |
| SCHEMBL6390835 | 0.76 | ALDH1A1 (0.41) | ALDH1A1TSHRHTT | |
| Hydrochloric Acid SCHEMBL10414692 | 0.76 | ALDH1A1 (0.41) | ALDH1A1TSHRHTT | |
| SCHEMBL9264394 | 0.72 | ALDH1A1 (0.31) | ALDH1A1TSHR | |
| SCHEMBL7371095 | 0.72 | — | — | |
| SCHEMBL16843453 | 0.70 | ALDH1A1 (0.35) | ALDH1A1TSHRHTT | |
| SCHEMBL30390434 | 0.70 | ALDH1A1 (0.39) | ALDH1A1TSHRHTT | |
| SCHEMBL3214356 | 0.69 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1644314-B1 | METHOD FOR PRODUCING DIFLUORO-ACETYL-ACETIC ACID ALKYLESTERS | BAYER CROPSCIENCE AG (DE) | 2011-08-10 | — | — | EP | disclosed |
| EP-1644314-A1 | METHOD FOR PRODUCING DIFLUORO-ACETYL-ACETIC ACID ALKYLESTERS | Bayer CropScience Aktiengesellschaft (DE) | 2006-04-12 | — | — | EP | disclosed |
| WO-2005003077-A1 | METHOD FOR PRODUCING DIFLUORO-ACETYL-ACETIC ACID ALKYLESTERS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2005-01-13 | — | — | WO | disclosed |