Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | KMO | O15229 | 3/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.30 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.30 |
| ▸ | CTSC | P53634 | 1/20 | 0.30 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL15520803 | 1.00 | GPR55 (0.38) | GPR55ALDH1A1PDE3BPDE3ABRD4 | |
| SCHEMBL15520533 | 1.00 | GPR55 (0.38) | GPR55ALDH1A1PDE3BPDE3ABRD4 | |
| SCHEMBL15520371 | 0.95 | GPR55 (0.37) | GPR55ALDH1A1PDE3BPDE3ABRD4 | |
| SCHEMBL15520532 | 0.95 | GPR55 (0.38) | GPR55ALDH1A1PDE3BPDE3ABRD4 | |
| SCHEMBL15520305 | 0.94 | CYP11B1 (0.35) | GPR55PDE3BPDE3ABRD4KMO | |
| SCHEMBL15520373 | 0.94 | GPR55 (0.40) | GPR55ALDH1A1PDE3BPDE3ABRD4 | |
| SCHEMBL15520206 | 0.93 | GPR55 (0.37) | GPR55ALDH1A1PDE3BPDE3ABRD4 | |
| SCHEMBL15520843 | 0.92 | GPR55 (0.36) | GPR55ALDH1A1PDE3BPDE3ABRD4 | |
| SCHEMBL15520702 | 0.91 | ALDH1A1 (0.40) | ALDH1A1BRD4KMOL3MBTL1USP2 | |
| SCHEMBL15519642 | 0.91 | GPR55 (0.37) | GPR55ALDH1A1PDE3BPDE3ABRD4 |
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 |