Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | AHCY | P23526 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28523272 | 1.00 | ALDH1A1 (0.42) | ALDH1A1PKMKMT2ASOS1MITF | |
| SCHEMBL28531344 | 0.88 | CHRM1 (0.47) | ALDH1A1PKMKMT2ASOS1MITF | |
| SCHEMBL5539609 | 0.88 | CHRM1 (0.47) | ALDH1A1PKMKMT2ASOS1MITF | |
| SCHEMBL15442198 | 0.86 | ALDH1A1 (0.40) | ALDH1A1PKMKMT2ASOS1MITF | |
| SCHEMBL13280994 | 0.86 | ALDH1A1 (0.40) | ALDH1A1PKMKMT2ASOS1MITF | |
| SCHEMBL13281114 | 0.86 | ALDH1A1 (0.40) | ALDH1A1PKMKMT2ASOS1MITF | |
| SCHEMBL17984901 | 0.84 | ALDH1A1 (0.44) | ALDH1A1PKMKMT2ASOS1MITF | |
| SCHEMBL28756702 | 0.84 | ALDH1A1 (0.43) | ALDH1A1PKMKMT2ASOS1MITF | |
| SCHEMBL27629456 | 0.84 | ALDH1A1 (0.46) | ALDH1A1PKMKMT2ASOS1MITF | |
| SCHEMBL27610264 | 0.84 | ALDH1A1 (0.46) | ALDH1A1PKMKMT2ASOS1MITF |
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-110483549-B | Preparation method of nitroimidazole pyran antituberculosis drug | 沈阳药科大学 | 2021-03-05 | — | — | CN | claimed |
| CN-110483549-B | Preparation method of nitroimidazole pyran antituberculosis drug | 沈阳药科大学 | 2021-03-05 | — | — | CN | disclosed |