Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 2/20 | 0.50 |
| ▸ | APP | P05067 | 2/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | KIF11 | P52732 | 1/20 | 0.44 |
| ▸ | RORC | P51449 | 4/20 | 0.44 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.43 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.43 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.43 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.43 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.43 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.43 |
| ▸ | RORA | P35398 | 1/20 | 0.42 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.42 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.42 |
| ▸ | PPARD | Q03181 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | FDFT1 | P37268 | 2/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9809580 | 0.96 | RARB (0.55) | RARBAPPAKR1C3AKR1C2MAOB | |
| SCHEMBL9809540 | 0.94 | RARB (0.57) | RARBAPPAKR1C3AKR1C2MAOB | |
| SCHEMBL10382745 | 0.94 | RARB (0.57) | RARBAPPAKR1C3AKR1C2MAOB | |
| SCHEMBL9809543 | 0.94 | RARB (0.57) | RARBAPPAKR1C3AKR1C2MAOB | |
| SCHEMBL9809587 | 0.94 | RARB (0.57) | RARBAPPAKR1C3AKR1C2MAOB | |
| SCHEMBL9809471 | 0.94 | RARB (0.57) | RARBAPPAKR1C3AKR1C2MAOB | |
| SCHEMBL9809533 | 0.94 | RARB (0.57) | RARBAPPAKR1C3AKR1C2MAOB | |
| SCHEMBL10381411 | 0.94 | RARB (0.57) | RARBAPPAKR1C3AKR1C2MAOB | |
| SCHEMBL8990710 | 0.93 | RARB (0.56) | RARBAPPAKR1C3AKR1C2MAOB | |
| SCHEMBL9809575 | 0.91 | APP (0.51) | RARBAPPAKR1C3AKR1C2MAOB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0427829-A1 | TRIFLUOROTOLUOL COMPOUNDS AND LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GmbH (DE) | 1991-05-22 | — | — | EP | disclosed |
| WO-1990014404-A1 | TRIFLUOROTOLUOL COMPOUNDS AND LIQUID CRYSTALLINE MEDIUM | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1990-11-29 | — | — | WO | disclosed |