Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | GAA | P10253 | 4/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | CASP1 | P29466 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | CASP7 | P55210 | 1/20 | 0.52 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | REN | P00797 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL25804417 | 0.82 | KMT2A (0.44) | ALDH1A1MAPTGAAMEN1KMT2A | |
| SCHEMBL14573732 | 0.78 | MAPT (0.46) | ALDH1A1MAPTGAAMEN1KMT2A | |
| SCHEMBL10328348 | 0.78 | HDAC1 (0.58) | ALDH1A1MAPTGAAMEN1KMT2A | |
| SCHEMBL11787204 | 0.78 | ALDH1A1 (0.67) | ALDH1A1MAPTGAAMEN1KMT2A | |
| SCHEMBL763105 | 0.77 | ALDH1A1 (0.55) | ALDH1A1MAPTGAAMEN1KMT2A | |
| SCHEMBL554421 | 0.77 | KLKB1 (0.45) | ALDH1A1MAPTGAAMEN1KMT2A | |
| SCHEMBL17689584 | 0.76 | ALDH1A1 (0.56) | ALDH1A1MAPTGAAMEN1KMT2A | |
| SCHEMBL14473305 | 0.76 | ALDH1A1 (0.50) | ALDH1A1MAPTGAAMEN1KMT2A | |
| SCHEMBL27192643 | 0.74 | MEN1 (0.43) | ALDH1A1MAPTGAAMEN1KMT2A | |
| SCHEMBL28805650 | 0.73 | HDAC1 (0.53) | HRH3RENCYP3A4HDAC1HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2316829-A1 | Heterocyclic derivatives as modulators of ion channels | Vertex Pharmaceuticals Incorporated (US) | 2011-05-04 | — | — | EP | disclosed |