Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29952523 | 0.86 | ALDH1A1 (0.44) | ALDH1A1HPGDPOLBHTTSMN1; SMN2 | |
| SCHEMBL29954704 | 0.86 | KMT2A (0.42) | ALDH1A1POLBHTTSMN1; SMN2MEN1 | |
| SCHEMBL29951806 | 0.85 | KMT2A (0.41) | ALDH1A1HPGDPOLBSMN1; SMN2MEN1 | |
| SCHEMBL29953981 | 0.79 | MEN1 (0.43) | ALDH1A1POLBHTTSMN1; SMN2MEN1 | |
| SCHEMBL29952279 | 0.76 | ALDH3A1 (0.41) | ALDH1A1SMN1; SMN2MEN1KMT2ATDP1 | |
| SCHEMBL2559520 | 0.73 | RORC (0.41) | ALDH1A1POLBMEN1KMT2ATDP1 | |
| SCHEMBL29951185 | 0.73 | ALDH1A3 (0.46) | ALDH1A1HPGDPOLBHTTL3MBTL1 | |
| SCHEMBL29951041 | 0.73 | KMT2A (0.48) | ALDH1A1HPGDPOLBSMN1; SMN2MEN1 | |
| SCHEMBL2563246 | 0.72 | SMN1; SMN2 (0.56) | ALDH1A1HPGDPOLBHTTSMN1; SMN2 | |
| SCHEMBL29950794 | 0.72 | KMT2A (0.41) | ALDH1A1HPGDPOLBHTTSMN1; 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 |