Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.41 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.41 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | AGXT | P21549 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1990360 | 0.85 | PARP10 (0.47) | PARP10ALDH1A1NPC1RAB9AKMT2A | |
| SCHEMBL28808716 | 0.82 | IDO1 (0.46) | ALDH1A1NPC1RAB9AKMT2AL3MBTL1 | |
| SCHEMBL28808693 | 0.80 | CYP3A4 (0.51) | IDO1AGXT | |
| SCHEMBL28808705 | 0.80 | IDO1 (0.51) | L3MBTL1IDO1 | |
| SCHEMBL28808706 | 0.80 | IDO1 (0.49) | PARP10ALDH1A1NPC1RAB9AKMT2A | |
| SCHEMBL28808697 | 0.78 | RAB9A (0.43) | PARP10NPC1RAB9AL3MBTL1IDO1 | |
| SCHEMBL28808704 | 0.78 | NR4A2 (0.46) | ALDH1A1NPC1RAB9AKMT2AL3MBTL1 | |
| SCHEMBL28808696 | 0.76 | IDO1 (0.49) | NPC1RAB9AKMT2AL3MBTL1IDO1 | |
| SCHEMBL28809464 | 0.76 | PARP10 (0.50) | PARP10ALDH1A1NPC1RAB9AKMT2A | |
| SCHEMBL28947455 | 0.76 | MAOB (0.44) | ALDH1A1 |
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-112079747-B | N-benzyloxy substituted symmetrical oxamide compound and preparation method and application thereof | 浙江工业大学 | 2022-08-16 | — | — | CN | disclosed |