Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.37 |
| ▸ | STAT3 | P40763 | 5/20 | 0.36 |
| ▸ | KDM5A | P29375 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | METAP2 | P50579 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21075953 | 0.80 | ALDH1A1 (0.43) | ALDH1A1STAT3KDM5AAPEX1POLB | |
| SCHEMBL24789857 | 0.80 | OR51E2 (0.37) | OR51E2KDM5AMAPTNPSR1 | |
| SCHEMBL25014735 | 0.79 | ALDH1A1 (0.44) | ALDH1A1STAT3APEX1POLBMEN1 | |
| SCHEMBL13618755 | 0.78 | DGAT1 (0.47) | ALDH1A1STAT3KDM5AAPEX1POLB | |
| SCHEMBL24050329 | 0.75 | RXFP1 (0.41) | ALDH1A1OR51E2POLBMEN1KMT2A | |
| SCHEMBL7523472 | 0.73 | SIGMAR1 (0.44) | ALDH1A1POLBMEN1KMT2AMAPT | |
| SCHEMBL10465699 | 0.72 | HSP90AA1 (0.41) | ALDH1A1KDM5AMEN1KMT2AMAPT | |
| SCHEMBL25622137 | 0.71 | ALDH1A1 (0.36) | ALDH1A1OR51E2STAT3APEX1POLB | |
| SCHEMBL24556716 | 0.71 | ALDH1A1 (0.34) | ALDH1A1OR51E2STAT3APEX1POLB | |
| SCHEMBL21558439 | 0.70 | ERN1 (0.53) | ALDH1A1POLBKMT2AMAPTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-3666772-A1 | DIARYLTHIOHYDANTOIN COMPOUND AS ANDROGEN RECEPTOR ANTAGONIST | Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) | 2020-06-17 | — | — | EP | disclosed |