Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.49 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.49 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 6/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | CRHBP | P24387 | 2/20 | 0.45 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL29253722 | 0.80 | KMT2A (0.51) | ALDH1A1KMT2ALMNAHTTNPC1 | |
| SCHEMBL22208968 | 0.78 | ALDH1A1 (0.51) | ALDH1A1KMT2ALMNAHTTNPC1 | |
| SCHEMBL15688855 | 0.75 | ALDH1A1 (0.42) | ALDH1A1KMT2ALMNAHTTNPC1 | |
| SCHEMBL8349572 | 0.75 | ALDH1A1 (0.44) | ALDH1A1KMT2ALMNAHTTNPC1 | |
| SCHEMBL31011691 | 0.75 | ALDH1A1 (0.51) | ALDH1A1KMT2ALMNAHTTNPC1 | |
| SCHEMBL23833481 | 0.75 | ALDH1A1 (0.51) | ALDH1A1KMT2ALMNAHTTMAPT | |
| SCHEMBL12454331 | 0.75 | DAO (0.45) | ALDH1A1KMT2ALMNAHTTNPC1 | |
| SCHEMBL15688593 | 0.75 | ALDH1A1 (0.43) | ALDH1A1KMT2ALMNAHTTNPC1 | |
| SCHEMBL12454324 | 0.75 | ALDH1A1 (0.43) | ALDH1A1KMT2ALMNAHTTNPC1 | |
| SCHEMBL9834028 | 0.75 | MAOB (0.53) | ALDH1A1KMT2ALMNAHTTNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104781251-B | Can as kinase modulator through the substituted pyridinyl compounds of bicyclic heterocycle | 百时美施贵宝公司 | 2016-12-14 | — | — | CN | disclosed |