Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TYMS | P04818 | 1/20 | 0.37 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 1/20 | 0.36 |
| ▸ | PLG | P00747 | 1/20 | 0.36 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | PLAT | P00750 | 1/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28485313 | 0.88 | GAA (0.44) | GAATYMSF2F10PLG | |
| SCHEMBL28485317 | 0.73 | NPC1 (0.56) | GAARAB9ASMN1; SMN2MAPTMEN1 | |
| SCHEMBL13777055 | 0.71 | ALDH1A1 (0.47) | MAPTMEN1KMT2AL3MBTL1KDM4E | |
| SCHEMBL28475608 | 0.68 | RAB9A (0.68) | GAARAB9ASMN1; SMN2MAPTMEN1 | |
| SCHEMBL18099812 | 0.66 | ALDH1A1 (0.50) | RAB9ASMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL2601574 | 0.65 | ALDH1A1 (0.51) | GAAF2RAB9AMAPTMEN1 | |
| SCHEMBL29773446 | 0.64 | RAB9A (0.55) | GAARAB9ASMN1; SMN2MAPTHTT | |
| SCHEMBL29773444 | 0.64 | RAB9A (0.55) | GAARAB9ASMN1; SMN2MAPTHTT | |
| SCHEMBL28007856 | 0.64 | RAB9A (0.55) | GAARAB9ASMN1; SMN2MAPTHTT | |
| 1-Nitropyrene SCHEMBL339725 | 0.64 | ALDH1A1 (0.57) | GAARAB9ASMN1; SMN2MAPTMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111471019-B | 5, 6-dinitrobenzimidazole compound and synthesis method and application thereof | 浙江工业大学 | 2021-10-01 | — | — | CN | disclosed |
| CN-111471019-A | 5, 6-dinitrobenzimidazole compound and synthesis method and application thereof | 浙江工业大学 | 2020-07-31 | — | — | CN | disclosed |