Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 7/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.40 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7101682 | 0.88 | ALDH1A1 (0.36) | ALDH1A1ESR1TSHRLMNAMAPK1 | |
| SCHEMBL7099715 | 0.85 | ALDH1A1 (0.44) | ALDH1A1ATMESR1TSHRHPGD | |
| SCHEMBL7100188 | 0.85 | ALDH1A1 (0.44) | ALDH1A1ATMESR1TSHRHPGD | |
| SCHEMBL16160294 | 0.84 | ALDH1A1 (0.50) | ALDH1A1ATMESR1TSHRHPGD | |
| SCHEMBL7100406 | 0.84 | ALDH1A1 (0.42) | ALDH1A1ATMESR1TSHRHPGD | |
| SCHEMBL379376 | 0.84 | ALDH1A1 (0.54) | ALDH1A1ATMESR1TSHRHPGD | |
| SCHEMBL6747488 | 0.83 | ALDH1A1 (0.58) | ALDH1A1ATMESR1TSHRHPGD | |
| SCHEMBL6247104 | 0.79 | ALDH1A1 (0.40) | ALDH1A1ESR1HPGDSMN1; SMN2LMNA | |
| SCHEMBL7100979 | 0.78 | MAPT (0.43) | ALDH1A1ATMESR1TSHRMAPK1 | |
| SCHEMBL10595821 | 0.78 | ALDH1A1 (0.58) | ALDH1A1ATMESR1TSHRHPGD |
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-1038861-B1 | 4-FLUORO-3-OXOCARBOXYLIC ESTERS AND PROCESS FOR PRODUCING THE SAME | UBE INDUSTRIES (JP) | 2003-09-03 | — | — | EP | disclosed |
| US-6593488-B1 | Reacting 2-fluorocarboxylate with carboxylate | UBE INDUSTRIES, LTD. (JP) | 2003-07-15 | — | — | US | disclosed |
| EP-1038861-A1 | 4-FLUORO-3-OXOCARBOXYLIC ESTERS AND PROCESS FOR PRODUCING THE SAME | UBE INDUSTRIES LIMITED (JP) | 2000-09-27 | — | — | EP | disclosed |