Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3574484 | 0.77 | L3MBTL1 (0.46) | ALDH1A1L3MBTL1KMT2ALMNAKDM4E | |
| SCHEMBL3567804 | 0.72 | ALDH1A1 (0.38) | ALDH1A1L3MBTL1KDM4EPKM | |
| SCHEMBL21683335 | 0.72 | ALDH1A1 (0.48) | ALDH1A1MAPTMEN1KMT2ALMNA | |
| SCHEMBL21683334 | 0.72 | ALDH1A1 (0.48) | ALDH1A1MAPTMEN1KMT2ALMNA | |
| SCHEMBL3584391 | 0.71 | ALDH1A1 (0.37) | ALDH1A1L3MBTL1KDM4EPKM | |
| SCHEMBL8306201 | 0.69 | L3MBTL1 (0.42) | ALDH1A1L3MBTL1MAPTMEN1KMT2A | |
| SCHEMBL21683336 | 0.67 | GAA (0.50) | ALDH1A1L3MBTL1MAPTMEN1KMT2A | |
| SCHEMBL21683337 | 0.67 | GAA (0.50) | ALDH1A1L3MBTL1MAPTMEN1KMT2A | |
| SCHEMBL13025273 | 0.67 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL9886522 | 0.67 | ALDH1A1 (0.48) | ALDH1A1MEN1KMT2ALMNAGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020032813-A1 | NEW 5-SUBSTITUTED DERIVATIVES OF 5-HYDRAZINO-3-METHYLISOTHIAZOLE-4- ACID CARBOXYLIC ACID WITH ANTI-TUMOR ACTIVITY AND THE METHOD OF THEIR PREPARATION AND USES | UNIWERSYTET MEDYCZNY IM. PIASTÓW ŚLĄSKICH WE WROCŁAWIU (PL) | 2020-02-13 | — | — | WO | disclosed |