Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TYK2 | P29597 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17398031 | 0.82 | KDM4E (0.44) | ALDH1A1KDM4EKMT2ANPC1RAB9A | |
| SCHEMBL17397958 | 0.79 | ITK (0.46) | ALDH1A1KDM4EHTR1AHTR2AHTR7 | |
| SCHEMBL17397980 | 0.78 | ALDH1A1 (0.44) | ALDH1A1KDM4EHTR1AHTR2AHTR7 | |
| SCHEMBL17398060 | 0.77 | AURKA (0.46) | KDR | |
| SCHEMBL17398026 | 0.77 | ITK (0.48) | ALDH1A1KDM4EHTR6KMT2ANPC1 | |
| SCHEMBL17397937 | 0.76 | HTR6 (0.43) | ALDH1A1KDM4EHTR6KMT2APOLB | |
| SCHEMBL17398079 | 0.75 | KMT2A (0.39) | ALDH1A1KDM4EHTR6KMT2ANPC1 | |
| SCHEMBL17398012 | 0.75 | ALDH1A1 (0.48) | ALDH1A1HTR6KMT2ANPC1RAB9A | |
| SCHEMBL17398074 | 0.74 | WDR5 (0.43) | HTR6KMT2ALMNA | |
| SCHEMBL17398018 | 0.71 | MAPT (0.44) | ALDH1A1KDM4ENPC1RAB9ASMN1; SMN2 |
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-2016001341-A1 | SULFONYLAMINOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE | F. HOFFMANN-LA ROCHE AG (CH) | 2016-01-07 | — | — | WO | disclosed |