Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL19981270 | 0.83 | BMP1 (0.40) | LRRK2POLBPKMMAPTHTT | |
| SCHEMBL19984831 | 0.83 | LRRK2 (0.35) | HDAC6LRRK2HDAC1POLBPKM | |
| SCHEMBL19984824 | 0.77 | HDAC6 (0.34) | HDAC6NAMPTCYP2C9CYP2C19 | |
| SCHEMBL19984805 | 0.73 | NPY5R (0.37) | HDAC6LRRK2POLBPKMMAPT | |
| SCHEMBL18078725 | 0.69 | CD274 (0.52) | POLB | |
| SCHEMBL19866357 | 0.69 | CD274 (0.52) | POLB | |
| SCHEMBL19984975 | 0.69 | TRHR (0.36) | MAPT | |
| SCHEMBL19973939 | 0.69 | MAPK1 (0.33) | POLB | |
| SCHEMBL19973940 | 0.69 | MAPK1 (0.33) | POLB | |
| SCHEMBL19981328 | 0.68 | BMP1 (0.36) | LRRK2POLBPKMMAPTHTT |
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 |