Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 9/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | MEN1 | O00255 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | NPC1 | O15118 | 4/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | RHOA | P61586 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4800383 | 0.76 | KEAP1 (0.44) | ALDH1A1MEN1KMT2ARAB9ACYP1A2 | |
| SCHEMBL29888246 | 0.76 | KEAP1 (0.44) | ALDH1A1MEN1KMT2ARAB9ACYP1A2 | |
| SCHEMBL4796549 | 0.76 | KDM4E (0.47) | ALDH1A1MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL12593846 | 0.75 | KEAP1 (0.62) | HTTALDH1A1MEN1KMT2ARAB9A | |
| SCHEMBL4798011 | 0.75 | ALDH1A1 (0.37) | ALDH1A1MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL28512569 | 0.74 | HTT (0.64) | HTTALDH1A1MEN1KMT2ARAB9A | |
| SCHEMBL18796013 | 0.74 | HTT (0.60) | HTTALDH1A1MEN1KMT2ARAB9A | |
| SCHEMBL11030583 | 0.74 | HTT (0.77) | HTTALDH1A1MEN1KMT2ARAB9A | |
| SCHEMBL4795217 | 0.73 | MAP4K4 (0.43) | ALDH1A1MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL20605542 | 0.73 | MAP4K4 (0.40) | ALDH1A1MEN1KMT2AMAP4K4KDM4E |
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-B | Diamine monomer containing pyrazine structure and preparation method thereof, polyimide containing pyrazine structure and preparation method thereof | 吉林大学 | 2021-01-15 | — | — | CN | disclosed |