Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR183 | P32249 | 12/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.44 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.44 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL16963768 | 1.00 | GPR183 (0.54) | GPR183KCNH2ALDH1A1NPC1RAB9A | |
| SCHEMBL21323311 | 1.00 | GPR183 (0.54) | GPR183KCNH2ALDH1A1NPC1RAB9A | |
| SCHEMBL16963765 | 1.00 | GPR183 (0.54) | GPR183KCNH2ALDH1A1NPC1RAB9A | |
| SCHEMBL21323086 | 0.90 | GPR183 (0.48) | GPR183KCNH2ALDH1A1NPC1RAB9A | |
| SCHEMBL16962980 | 0.90 | GPR183 (0.48) | GPR183KCNH2ALDH1A1NPC1RAB9A | |
| SCHEMBL16962977 | 0.90 | GPR183 (0.48) | GPR183KCNH2ALDH1A1NPC1RAB9A | |
| SCHEMBL21323342 | 0.89 | ENPP2 (0.46) | GPR183KCNH2 | |
| SCHEMBL16961758 | 0.89 | ENPP2 (0.46) | GPR183KCNH2 | |
| SCHEMBL21322990 | 0.89 | GPR183 (0.41) | GPR183KCNH2ALDH1A1NPC1RAB9A | |
| SCHEMBL16961762 | 0.89 | ENPP2 (0.46) | GPR183KCNH2 |
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 |