Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 3/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | CETP | P11597 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | PLAU | P00749 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7666811 | 0.80 | HDAC3 (0.49) | ALDH1A1GAAPKMCETPHDAC3 | |
| SCHEMBL23387253 | 0.78 | POLB (0.47) | ALDH1A1GAASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL27799461 | 0.78 | HDAC3 (0.61) | ALDH1A1GAACETPHDAC3HDAC1 | |
| SCHEMBL31056261 | 0.78 | AAK1 (0.49) | ALDH1A1GAAHPGDSMN1; SMN2MEN1 | |
| SCHEMBL13936400 | 0.77 | NPC1 (0.52) | ALDH1A1GAAHPGDSMN1; SMN2KDM4E | |
| SCHEMBL12723707 | 0.77 | GHSR (0.41) | ALDH1A1CETPHPGDSMN1; SMN2KDM4E | |
| SCHEMBL28592805 | 0.77 | CYP2C19 (0.64) | ALDH1A1GAAPKMCETPHDAC3 | |
| SCHEMBL17544709 | 0.77 | GAA (0.60) | ALDH1A1GAAPKMCETPHDAC3 | |
| SCHEMBL29721597 | 0.77 | GAA (0.60) | ALDH1A1GAAPKMCETPHDAC3 | |
| SCHEMBL4780965 | 0.76 | GAA (0.53) | ALDH1A1GAAPKMCETPHDAC3 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |