Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | KMO | O15229 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.33 |
| ▸ | RORC | P51449 | 2/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | CTSC | P53634 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.31 |
| ▸ | UTS2R | Q9UKP6 | 3/20 | 0.31 |
| ▸ | USP30 | Q70CQ3 | 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 | |
|---|---|---|---|---|
| SCHEMBL15520371 | 0.91 | GPR55 (0.37) | GPR55TSHRNPSR1KMOALDH1A1 | |
| SCHEMBL15520206 | 0.90 | GPR55 (0.37) | GPR55TSHRNPSR1KMOALDH1A1 | |
| SCHEMBL15520533 | 0.89 | GPR55 (0.38) | GPR55TSHRNPSR1KMOALDH1A1 | |
| SCHEMBL15520752 | 0.89 | GPR55 (0.38) | GPR55TSHRNPSR1KMOALDH1A1 | |
| SCHEMBL15520803 | 0.89 | GPR55 (0.38) | GPR55TSHRNPSR1KMOALDH1A1 | |
| SCHEMBL15520532 | 0.89 | GPR55 (0.38) | GPR55TSHRNPSR1KMOALDH1A1 | |
| SCHEMBL474579 | 0.88 | GPR55 (0.35) | GPR55ALDH1A1NR1H2NR1H3RORC | |
| SCHEMBL12163813 | 0.88 | GPR55 (0.35) | GPR55ALDH1A1NR1H2NR1H3RORC | |
| SCHEMBL15520843 | 0.88 | GPR55 (0.36) | GPR55TSHRKMOALDH1A1PDE3B | |
| SCHEMBL15519642 | 0.88 | GPR55 (0.37) | GPR55KMOALDH1A1THRBPDE3B |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2411365-B1 | 2,3-DIARYL- OR HETEROARYL-SUBSTITUTED 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS | HOFFMANN LA ROCHE (CH) | 2014-03-19 | — | — | EP | claimed |