Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | APEX1 | P27695 | 1/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10049316 | 0.94 | ALDH1A1 (0.61) | ALDH1A1KDM4EMAPTHPGDCYP3A4 | |
| SCHEMBL19056940 | 0.82 | TP53 (0.43) | ALDH1A1KDM4EMAPTESR2NPSR1 | |
| SCHEMBL9624835 | 0.79 | NQO1 (0.50) | ALDH1A1KDM4EMAPTTSHRTP53 | |
| SCHEMBL22708311 | 0.79 | ALDH1A1 (0.59) | ALDH1A1KDM4EMAPTHPGDCYP3A4 | |
| SCHEMBL13141933 | 0.78 | KDM4E (0.89) | ALDH1A1KDM4EMAPTHPGDESR2 | |
| SCHEMBL9477209 | 0.78 | NFE2L2 (0.59) | ALDH1A1KDM4EHPGDCYP3A4TSHR | |
| SCHEMBL3847817 | 0.78 | ALDH1A1 (0.57) | ALDH1A1KDM4EMAPTHPGDCYP3A4 | |
| SCHEMBL18185622 | 0.78 | ALDH1A1 (0.57) | ALDH1A1KDM4EMAPTHPGDCYP3A4 | |
| SCHEMBL18185621 | 0.78 | ALDH1A1 (0.57) | ALDH1A1KDM4EMAPTHPGDCYP3A4 | |
| SCHEMBL3847813 | 0.78 | ALDH1A1 (0.57) | ALDH1A1KDM4EMAPTHPGDCYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0325796-B1 | A LIQUID CRYSTAL COMPOUND AND A MIXTURE CONTAINING THE SAME | Chisso Corporation (JP) | 1992-03-11 | — | — | EP | disclosed |
| US-4877548-A | STABLE TO HEAT, LIGHT, ELECTRICITY AND MOISTURE | CHISSO CORPORATION (JP) | 1989-10-31 | — | — | US | disclosed |