Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.34 |
| ▸ | KMO | O15229 | 1/20 | 0.33 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.33 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.33 |
| ▸ | PGK1 | P00558 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29954232 | 0.85 | NPC1 (0.37) | GAANPC1CHEK1ALDH1A1KDM4E | |
| SCHEMBL18797516 | 0.75 | GAA (0.41) | GAANPC1CHEK1ALDH1A1KDM4E | |
| SCHEMBL31574402 | 0.75 | GAA (0.41) | GAANPC1CHEK1ALDH1A1KDM4E | |
| SCHEMBL29954133 | 0.75 | CD44 (0.32) | ALDH1A1KDM4ESMN1; SMN2POLB | |
| SCHEMBL30503613 | 0.74 | NPC1 (0.43) | GAANPC1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL1424930 | 0.74 | NPC1 (0.43) | GAANPC1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL25347088 | 0.72 | GAA (0.42) | GAANPC1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL16200086 | 0.72 | SLC6A2 (0.43) | GAANPC1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL29513500 | 0.72 | GAA (0.42) | GAANPC1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL29637517 | 0.71 | DYRK1A (0.53) | GAANPC1ALDH1A1KDM4ESMN1; 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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |