Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 4/20 | 0.41 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | POLQ | O75417 | 1/20 | 0.34 |
| ▸ | RXRA | P19793 | 1/20 | 0.34 |
| ▸ | CCNC | P24863 | 1/20 | 0.34 |
| ▸ | CDK8 | P49336 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL27316876 | 0.86 | KAT6A (0.34) | ALDH1A1RXRACCNCCDK8MAPT | |
| SCHEMBL27316789 | 0.82 | BRD4 (0.35) | HSD17B1HSD17B2RXRACCNCCDK8 | |
| SCHEMBL27316881 | 0.75 | ALDH1A1 (0.40) | ALDH1A1HPGDNPC1MAPTBRD4 | |
| SCHEMBL27316791 | 0.75 | L3MBTL1 (0.45) | KDM4EALDH1A1HPGDHSD17B10NPC1 | |
| SCHEMBL27316797 | 0.73 | GRM3 (0.38) | ALDH1A1NPC1RAB9ABRD4TP53 | |
| SCHEMBL21180776 | 0.72 | BAZ2B (0.42) | ALDH1A1HSD17B10PLK1BRD4SMN1; SMN2 | |
| SCHEMBL27316798 | 0.72 | PIK3CA (0.38) | ALDH1A1TP53 | |
| SCHEMBL27316874 | 0.71 | ALDH1A1 (0.39) | ALDH1A1RXRACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL27316879 | 0.70 | GCK (0.36) | ALDH1A1RXRACCNCCDK8BRD4 | |
| SCHEMBL2952197 | 0.70 | ALDH1A1 (0.53) | HSD17B1HSD17B2ALDH1A1RXRACYP1A2 |
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-2024057020-A1 | ANTI-VIRAL COMPOUNDS | Infex Therapeutics Limited (GB) | 2024-03-21 | — | — | WO | disclosed |