Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TNKS | O95271 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.33 |
| ▸ | VNN1 | O95497 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19984850 | 0.83 | HDAC6 (0.40) | LRRK2HDAC6DYRK1AHDAC1GSK3B | |
| SCHEMBL19984975 | 0.76 | TRHR (0.36) | TNKSPARP1PARP2ALDH1A1 | |
| SCHEMBL19866357 | 0.74 | CD274 (0.52) | MEN1POLBKMT2A | |
| SCHEMBL18078725 | 0.74 | CD274 (0.52) | MEN1POLBKMT2A | |
| SCHEMBL19973940 | 0.72 | MAPK1 (0.33) | MEN1POLBKMT2A | |
| SCHEMBL19973939 | 0.72 | MAPK1 (0.33) | MEN1POLBKMT2A | |
| SCHEMBL19984824 | 0.71 | HDAC6 (0.34) | HDAC6CYP2C9CYP2C19 | |
| SCHEMBL19981151 | 0.67 | SMN1; SMN2 (0.41) | PKMSMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL19981270 | 0.66 | BMP1 (0.40) | LRRK2DYRK1AGSK3BPKMALDH1A1 | |
| SCHEMBL31153424 | 0.65 | VNN1 (0.50) | SMN1; SMN2VNN1ALDH1A1NPC1RAB9A |
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-2018051255-A1 | CYCLIC SUBSTITUTED-1,3,4-OXADIAZOLE AND THIADIAZOLE COMPOUNDS AS IMMUNOMODULATORS | AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) | 2018-03-22 | — | — | WO | disclosed |