Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABBR2 | O75899 | 1/20 | 0.50 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.50 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.50 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | TNKS | O95271 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8972871 | 1.00 | GABBR2 (0.50) | GABBR2GABRB1GABRB2GABBR1CYP1A2 | |
| SCHEMBL6513856 | 1.00 | GABBR2 (0.50) | GABBR2GABRB1GABRB2GABBR1CYP1A2 | |
| SCHEMBL8973181 | 1.00 | GABBR2 (0.50) | GABBR2GABRB1GABRB2GABBR1CYP1A2 | |
| SCHEMBL8973184 | 1.00 | GABBR2 (0.50) | GABBR2GABRB1GABRB2GABBR1CYP1A2 | |
| SCHEMBL8972865 | 1.00 | GABBR2 (0.50) | GABBR2GABRB1GABRB2GABBR1CYP1A2 | |
| SCHEMBL8404223 | 1.00 | GABBR2 (0.50) | GABBR2GABRB1GABRB2GABBR1CYP1A2 | |
| SCHEMBL27984377 | 0.83 | CYP1A2 (0.47) | GABBR2GABRB1GABRB2GABBR1CYP1A2 | |
| SCHEMBL10723686 | 0.82 | GABBR2 (0.44) | GABBR2GABRB1GABRB2GABBR1CYP1A2 | |
| SCHEMBL10723695 | 0.82 | GABBR2 (0.44) | GABBR2GABRB1GABRB2GABBR1CYP1A2 | |
| SCHEMBL7021780 | 0.79 | GABRB2 (0.50) | GABBR2GABRB1GABRB2GABBR1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2005015400-A | TRIFLUOROMETHYLCINNAMYL ALCOHOL AND ITS MANUFACTURING METHOD | CENTRAL GLASS CO LTD | 2005-01-20 | — | — | JP | disclosed |
| US-4532020-A | Reacting alkyne with fluorine-containing aldehyde in presence of catalyst under ultrasonic irradiation | DAIKIN KOGYO CO., LTD. (JP) | 1985-07-30 | — | — | US | disclosed |
| EP-0118890-A1 | Process for preparing a beta-(fluoroalkyl or fluoroalkenyl)-beta-hydroxyalkyne and an alpha-(fluoroalkyl or fluoroalkenyl)-allyl alcohol thereof | Daikin Kogyo Co., Ltd. (JP) | 1984-09-19 | — | — | EP | disclosed |