Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 7/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALPG | P10696 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | CD44 | P16070 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1049862 | 0.82 | CYP3A4 (0.35) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL1311843 | 0.80 | ALDH1A1 (0.39) | ALDH1A1KDM4ECYP3A4TSHRTDP1 | |
| SCHEMBL11769835 | 0.80 | CYP3A4 (0.40) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL10290089 | 0.78 | CYP3A4 (0.36) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL3420520 | 0.77 | ALDH1A1 (0.43) | ALDH1A1KDM4ECYP3A4TSHRTDP1 | |
| SCHEMBL14877406 | 0.75 | ALDH1A1 (0.39) | ALDH1A1KDM4EGAAHPGDHSD17B10 | |
| SCHEMBL29818730 | 0.74 | ALDH1A1 (0.44) | ALDH1A1KDM4ECYP3A4TSHRTDP1 | |
| SCHEMBL22095175 | 0.74 | KDM4E (0.43) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL3975489 | 0.73 | ERN1 (0.43) | KDM4ECYP3A4TDP1MAPTTP53 | |
| SCHEMBL18300001 | 0.73 | ERN1 (0.40) | ALDH1A1TSHRTDP1CYP2A6MEN1 |
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 |