Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1AN | Q9NWT6 | 8/20 | 0.54 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.51 |
| ▸ | ACHE | P22303 | 5/20 | 0.51 |
| ▸ | BCHE | P06276 | 3/20 | 0.51 |
| ▸ | MAOB | P27338 | 2/20 | 0.49 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL998223 | 1.00 | HIF1AN (0.54) | HIF1ANABCG2ACHEBCHEMAOB | |
| SCHEMBL996376 | 0.99 | HIF1AN (0.53) | HIF1ANABCG2ACHEBCHEMAOB | |
| SCHEMBL996379 | 0.99 | HIF1AN (0.53) | HIF1ANABCG2ACHEBCHEMAOB | |
| SCHEMBL998195 | 0.92 | HIF1AN (0.54) | HIF1ANABCG2TUBB1CYP3A4CYP2D6 | |
| SCHEMBL998194 | 0.92 | HIF1AN (0.54) | HIF1ANABCG2TUBB1CYP3A4CYP2D6 | |
| SCHEMBL998727 | 0.88 | MAPT (0.59) | HIF1ANABCG2MAOBTUBB1CYP3A4 | |
| SCHEMBL998730 | 0.88 | MAPT (0.59) | HIF1ANABCG2MAOBTUBB1CYP3A4 | |
| SCHEMBL997108 | 0.87 | MAPT (0.60) | HIF1ANABCG2ACHEBCHEMAOB | |
| SCHEMBL997110 | 0.87 | MAPT (0.60) | HIF1ANABCG2ACHEBCHEMAOB | |
| SCHEMBL996372 | 0.86 | ACHE (0.52) | HIF1ANABCG2ACHEBCHEMAOB |
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-2011009826-A2 | NOVEL CHALCONE DERIVATIVES WITH CYTOTOXIC ACTIVITY | ADAMED Sp.z o.o. (PL) | 2011-01-27 | — | — | WO | disclosed |