Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| Styrene SCHEMBL9734990 | 0.69 | ALDH1A1 (0.42) | — | |
| SCHEMBL3066773 | 0.67 | HDAC4 (0.37) | HDAC4HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL28618972 | 0.67 | PDK2 (0.36) | CES2CES1PDK2 | |
| SCHEMBL180426 | 0.66 | — | — | |
| SCHEMBL9228474 | 0.65 | HDAC4 (0.42) | HDAC4CES2BCHECES1PDK2 | |
| SCHEMBL9228999 | 0.65 | HDAC4 (0.39) | HDAC4CES2BCHECES1HDAC3 | |
| SCHEMBL5101790 | 0.65 | HDAC4 (0.39) | HDAC4CES2BCHECES1HDAC3 | |
| SCHEMBL23231960 | 0.65 | HDAC4 (0.50) | HDAC4CES2BCHECES1PDK2 | |
| SCHEMBL3067734 | 0.65 | HDAC4 (0.46) | HDAC4CES2BCHECES1HDAC3 | |
| SCHEMBL17452149 | 0.65 | HDAC4 (0.46) | HDAC4CES2BCHECES1PDK2 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2225432-A | — | — | None | — | — | JP | disclosed |
| EP-0337820-B1 | PENTAFLUOROPHENYL DERIVATIVES, METHODS OF PRODUCTION OF SUCH DERIVATIVES INCLUDING OPTICALLY ACTIVE DERIVATIVES, AND METHOD OF OPTICAL RESOLUTION OF CHIRAL CARBOXYLIC ACIDS | NIKKO KYODO CO., LTD. (JP) | 1993-07-28 | — | — | EP | disclosed |
| US-5041641-A | Pentafluorophenyl derivatives, methods of production thereof, and method of optical resolution of chiral carboxylic acids | NIPPON MINING COMPANY LIMITED (JP) | 1991-08-20 | — | — | US | disclosed |
| US-5041641-A | Pentafluorophenyl derivatives, methods of production thereof, and method of optical resolution of chiral carboxylic acids | NIPPON MINING COMPANY LIMITED (JP) | 1991-08-20 | — | — | US | disclosed |
| JP-H02225432-A | 2-FLUORO-2-(PENTAFLUOROPHENYL)ETHANOL AND ITS PRODUCTION | NIPPON MINING CO LTD | 1990-09-07 | — | — | JP | disclosed |
| EP-0337820-A1 | Pentafluorophenyl derivatives, methods of production of such derivatives including optically active derivatives, and method of optical resolution of chiral carboxylic acids | NIKKO KYODO CO., LTD. (JP) | 1989-10-18 | — | — | EP | disclosed |
| EP-0337820-A1 | Pentafluorophenyl derivatives, methods of production of such derivatives including optically active derivatives, and method of optical resolution of chiral carboxylic acids | NIKKO KYODO CO., LTD. (JP) | 1989-10-18 | — | — | EP | disclosed |
| US-4497964-A | CARBONYLATION, HYDROGENATION | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 1985-02-05 | — | — | US | disclosed |