Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR183 | P32249 | 17/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.37 |
| ▸ | ATXN2 | Q99700 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16962295 | 1.00 | GPR183 (0.41) | GPR183KCNH2ALDH1A1NPC1RAB9A | |
| SCHEMBL16962300 | 1.00 | GPR183 (0.41) | GPR183KCNH2ALDH1A1NPC1RAB9A | |
| SCHEMBL17310761 | 0.96 | GPR183 (0.38) | GPR183KCNH2ALDH1A1NPC1RAB9A | |
| SCHEMBL17310954 | 0.96 | GPR183 (0.38) | GPR183KCNH2ALDH1A1NPC1RAB9A | |
| SCHEMBL17310759 | 0.96 | GPR183 (0.38) | GPR183KCNH2ALDH1A1NPC1RAB9A | |
| SCHEMBL17310956 | 0.96 | GPR183 (0.38) | GPR183KCNH2ALDH1A1NPC1RAB9A | |
| SCHEMBL17310952 | 0.96 | GPR183 (0.38) | GPR183KCNH2ALDH1A1NPC1RAB9A | |
| SCHEMBL16962448 | 0.93 | GPR183 (0.39) | GPR183KCNH2ENPP2ATXN2 | |
| SCHEMBL21322998 | 0.93 | GPR183 (0.39) | GPR183KCNH2ENPP2ATXN2 | |
| SCHEMBL16962446 | 0.93 | GPR183 (0.39) | GPR183KCNH2ENPP2ATXN2 |
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-2900669-B1 | HEXAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AND RELATED COMPOUNDS AS AUTOTAXIN (ATX) INHIBITORS AND AS INHIBITORS OF THE LYSOPHOSPHATIDIC ACID (LPA) PRODUCTION FOR TREATING E.G. RENAL DISEASES | HOFFMANN LA ROCHE (CH) | 2019-09-04 | — | — | EP | disclosed |