Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.48 |
| ▸ | BAD | Q92934 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | MITF | O75030 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8387743 | 0.83 | MAPT (0.50) | CES2CA1CA2MAPTALDH1A1 | |
| SCHEMBL2914675 | 0.82 | NFE2L2 (0.46) | CES2CES1CA1CA2MAPT | |
| SCHEMBL28827764 | 0.82 | NFE2L2 (0.46) | CES2CES1CA1CA2MAPT | |
| SCHEMBL7071606 | 0.81 | CYP1A2 (0.50) | CES2CES1CA1CA2MAPT | |
| SCHEMBL7070720 | 0.81 | ALOX15 (0.52) | CES2CES1CA1CA2MAPT | |
| SCHEMBL7071425 | 0.81 | ALDH1A1 (0.52) | CES2CES1CA2MAPTALDH1A1 | |
| SCHEMBL3165945 | 0.80 | CES2 (0.52) | CES2CES1BCL2L1BADCA1 | |
| Fluoride SCHEMBL11179978 | 0.80 | NFE2L2 (0.45) | CES2CES1CA1CA2MAPT | |
| Hydrochloric Acid SCHEMBL10530955 | 0.79 | ALDH1A1 (0.50) | CES2CES1CA2MAPTALDH1A1 | |
| SCHEMBL7074206 | 0.79 | SMN1; SMN2 (0.50) | MAPTALDH1A1MEN1POLBKMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0946492-B1 | NOVEL 2-FLUOROACRYLIC ACID DERIVATIVES, NOVEL MIXTURES OF HERBICIDES AND ANTIDOTES AND THE USE THEREOF | BAYER CROPSCIENCE GMBH (DE) | 2003-06-18 | — | — | EP | claimed |
| US-5972839-A | MIXTURE WITH PLANT SAFENING AGENT | HOECHST SCHERING AGREVO GMBH (DE) | 1999-10-26 | — | — | US | claimed |
| CN-114957170-B | Ether compound ortho carbon-hydrogen bond direct monofluoroalkenyl reaction | 滁州学院 | 2024-05-24 | — | — | CN | disclosed |
| CN-114957170-A | Direct monofluoroolefination reaction of ether compound ortho-position carbon-hydrogen bond | 滁州学院 | 2022-08-30 | — | — | CN | disclosed |
| US-5972839-A | MIXTURE WITH PLANT SAFENING AGENT | HOECHST SCHERING AGREVO GMBH (DE) | 1999-10-26 | — | — | US | disclosed |