Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 4/20 | 0.46 |
| ▸ | WNT3A | P56704 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | JAK1 | P23458 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL997528 | 0.90 | CTNNB1 (0.58) | CTNNB1WNT3AALDH1A1MAPTMEN1 | |
| SCHEMBL997046 | 0.86 | MAPT (0.42) | ALDH1A1MAPTMEN1KMT2AHPGD | |
| SCHEMBL32680615 | 0.81 | CTNNB1 (0.54) | CTNNB1WNT3AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL27140256 | 0.81 | CTNNB1 (0.54) | CTNNB1WNT3AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL29383324 | 0.79 | TSHR (0.61) | CTNNB1ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL999704 | 0.79 | TSHR (0.61) | CTNNB1ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL21385292 | 0.76 | ALDH1A1 (0.55) | CTNNB1WNT3AALDH1A1MAPTMEN1 | |
| SCHEMBL997040 | 0.74 | MAPT (0.42) | CTNNB1WNT3AALDH1A1MAPTMEN1 | |
| SCHEMBL15979768 | 0.72 | CTNNB1 (0.82) | CTNNB1WNT3AALDH1A1MAPTHPGD | |
| SCHEMBL998638 | 0.72 | ALDH1A1 (0.62) | CTNNB1WNT3AALDH1A1MAPTMEN1 |
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 |