Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.64 |
| ▸ | ESR1 | P03372 | 2/20 | 0.64 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.64 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.59 |
| ▸ | LTA4H | P09960 | 1/20 | 0.52 |
| ▸ | IDO1 | P14902 | 2/20 | 0.52 |
| ▸ | MAOB | P27338 | 2/20 | 0.52 |
| ▸ | MTOR | P42345 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | MIF | P14174 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HTR3A | P46098 | 1/20 | 0.48 |
| ▸ | BACE1 | P56817 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL934227 | 0.88 | TAAR1 (0.73) | TAAR1IDO1MAOBMIFKDM4E | |
| SCHEMBL5651022 | 0.86 | KIF11 (0.64) | KIF11ESR1ESR2TAAR1LTA4H | |
| SCHEMBL57109 | 0.85 | KIF11 (0.84) | KIF11ESR1ESR2MTORMEN1 | |
| SCHEMBL8071223 | 0.83 | FFAR1 (0.54) | KIF11ESR1ESR2TAAR1MTOR | |
| SCHEMBL11756670 | 0.83 | KIF11 (0.80) | KIF11ESR1ESR2MTORMEN1 | |
| Hydrochloric Acid SCHEMBL18955872 | 0.83 | KIF11 (0.80) | KIF11ESR1ESR2IDO1MTOR | |
| SCHEMBL27509291 | 0.83 | KIF11 (0.80) | KIF11ESR1ESR2MTORMEN1 | |
| Hydrochloric Acid SCHEMBL29242575 | 0.83 | KIF11 (0.80) | KIF11ESR1ESR2IDO1MTOR | |
| Potassium SCHEMBL30655561 | 0.83 | KIF11 (0.80) | KIF11ESR1ESR2MTORMEN1 | |
| SCHEMBL28039722 | 0.83 | KIF11 (0.80) | KIF11ESR1ESR2MTORMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4614608-A | LIQUID CRYSTALS; 1-(4-HYDROXYPHENYL)-2-(41-TRIFLUOROMETHYLPHENYL) ETHANE ESTERS | THOMSON-CSF (FR) | 1986-09-30 | — | — | US | disclosed |
| EP-0157679-A1 | Organic compound showing a smectic phase A, mixture containing this compound and process for making it | THOMSON-CSF (FR) | 1985-10-09 | — | — | EP | disclosed |