Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 3/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.38 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.38 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL29963773 | 0.90 | NPC1 (0.39) | P4HTMMAOBMEN1KMT2AGRM5 | |
| SCHEMBL15311222 | 0.90 | NPC1 (0.39) | P4HTMMAOBMEN1KMT2AGRM5 | |
| SCHEMBL22933186 | 0.84 | MAPK14 (0.43) | P4HTMMAOBMCHR1MEN1KMT2A | |
| SCHEMBL22933184 | 0.81 | MAPK14 (0.47) | MAPK14 | |
| SCHEMBL24461392 | 0.81 | MAPKAPK5 (0.45) | MAPK14 | |
| SCHEMBL29617129 | 0.81 | MAPKAPK5 (0.45) | MAPK14 | |
| SCHEMBL24926717 | 0.78 | POLB (0.36) | — | |
| SCHEMBL24759796 | 0.76 | MAOB (0.41) | MAOBMCHR1MEN1KMT2AGRM5 | |
| SCHEMBL29962567 | 0.76 | MAOB (0.41) | MAOBMCHR1MEN1KMT2AGRM5 | |
| SCHEMBL30519920 | 0.76 | MAPKAPK5 (0.39) | MAPK14 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021022186-A1 | DEUTERATED MK2 PATHWAY INHIBITORS AND METHODS OF USING THE SAME | ACLARIS THERAPEUTICS, INC. (US) | 2021-02-04 | — | — | WO | disclosed |