Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | NAAA | Q02083 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL15657310 | 1.00 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2PKMGAAHDAC3 | |
| SCHEMBL15659605 | 1.00 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2PKMGAAHDAC3 | |
| SCHEMBL15662096 | 0.86 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2PKMGAAHDAC3 | |
| SCHEMBL15657795 | 0.86 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2PKMGAAHDAC3 | |
| SCHEMBL16414641 | 0.86 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2PKMGAAHDAC3 | |
| SCHEMBL15659169 | 0.86 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2PKMGAAHDAC3 | |
| SCHEMBL2719119 | 0.81 | SMN1; SMN2 (0.84) | ALDH1A1SMN1; SMN2PKMGAAHDAC3 | |
| SCHEMBL15999997 | 0.81 | SMN1; SMN2 (0.84) | ALDH1A1SMN1; SMN2PKMGAAHDAC3 | |
| SCHEMBL9784444 | 0.81 | SMN1; SMN2 (0.84) | ALDH1A1SMN1; SMN2PKMGAAHDAC3 | |
| SCHEMBL15660841 | 0.81 | NAAA (0.63) | ALDH1A1HDAC3NAAATLR2 |
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-2014066613-A2 | SPHINGOLIPID METABOLITE MIMETICS | ZHEJIANG UNIVERSITY (CN) | 2014-05-01 | — | — | WO | disclosed |