Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.63 |
| ▸ | LMNA | P02545 | 3/20 | 0.63 |
| ▸ | HTT | P42858 | 2/20 | 0.63 |
| ▸ | HSPB1 | P04792 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | MYOC | Q99972 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11387678 | 0.89 | RAB9A (0.56) | RAB9ALMNAHTTHSPB1MAPT | |
| SCHEMBL28257557 | 0.81 | KDM4E (0.58) | RAB9ALMNAHTTHSPB1MAPT | |
| SCHEMBL20932230 | 0.79 | HSPB1 (0.82) | RAB9ALMNAHTTHSPB1MAPT | |
| SCHEMBL11689190 | 0.78 | HSPB1 (0.79) | RAB9ALMNAHTTHSPB1MAPT | |
| SCHEMBL9183872 | 0.78 | HSPB1 (0.79) | RAB9ALMNAHTTHSPB1MAPT | |
| SCHEMBL2011179 | 0.78 | HSPB1 (0.79) | RAB9ALMNAHTTHSPB1MAPT | |
| 4,4'-Oxybis(Nitrobenzene) SCHEMBL134332 | 0.78 | HSPB1 (0.79) | RAB9ALMNAHTTHSPB1MAPT | |
| SCHEMBL9326257 | 0.77 | HTT (0.74) | RAB9ALMNAHTTHSPB1MAPT | |
| 4,4'-Oxybis(Nitrobenzene) SCHEMBL8934595 | 0.76 | HSPB1 (0.76) | RAB9ALMNAHTTHSPB1MAPT | |
| SCHEMBL12050816 | 0.76 | HSPB1 (0.55) | RAB9ALMNAHTTHSPB1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-108947918-A | A kind of polyimides and preparation method thereof of diamine monomer of the structure containing pyrazine and preparation method thereof and a kind of structure containing pyrazine | 吉林大学 | 2018-12-07 | — | — | CN | disclosed |