Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | MAOB | P27338 | 9/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.45 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.45 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL997608 | 0.89 | KDM4E (0.55) | TSHRALDH1A1KDM4EMAPTMEN1 | |
| SCHEMBL999447 | 0.82 | ALDH1A1 (0.53) | TSHRALDH1A1KDM4EMAPTMEN1 | |
| Hydrochloric Acid SCHEMBL996594 | 0.81 | TSHR (0.47) | TSHRKDM4EMAPTMAOBMEN1 | |
| SCHEMBL997477 | 0.78 | MAOB (0.56) | MAPTMAOBHRH3DRD2DRD3 | |
| SCHEMBL997479 | 0.78 | MAOB (0.56) | MAPTMAOBHRH3DRD2DRD3 | |
| SCHEMBL998730 | 0.78 | MAPT (0.59) | TSHRALDH1A1KDM4EMAPTMAOB | |
| SCHEMBL998727 | 0.78 | MAPT (0.59) | TSHRALDH1A1KDM4EMAPTMAOB | |
| SCHEMBL21681999 | 0.78 | POLB (0.53) | TSHRALDH1A1KDM4EMAPTMEN1 | |
| SCHEMBL996372 | 0.78 | ACHE (0.52) | ALDH1A1KDM4EMAOBHPGD | |
| SCHEMBL996370 | 0.78 | ACHE (0.52) | ALDH1A1KDM4EMAOBHPGD |
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 |