Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 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 | |
|---|---|---|---|---|
| SCHEMBL21043326 | 0.84 | GAA (0.36) | ALDH1A1KDM4EMAPTGAAHPGD | |
| SCHEMBL20576855 | 0.80 | KDM4E (0.42) | ALDH1A1KDM4EMAPTGAAHPGD | |
| SCHEMBL13182869 | 0.76 | ALDH1A1 (0.47) | ALDH1A1KDM4EMAPTGAAHPGD | |
| SCHEMBL31541719 | 0.75 | THRB (0.47) | ALDH1A1KDM4EMAPTGAAHPGD | |
| SCHEMBL29775267 | 0.74 | ALDH1A1 (0.46) | ALDH1A1KDM4EMAPTGAAHPGD | |
| SCHEMBL1754056 | 0.74 | ALDH1A1 (0.46) | ALDH1A1KDM4EMAPTGAAHPGD | |
| SCHEMBL2770254 | 0.74 | CA12 (0.51) | ALDH1A1KDM4EMAPTGAAHPGD | |
| SCHEMBL21043298 | 0.74 | KDM4E (0.41) | ALDH1A1KDM4EMAPTGAAHPGD | |
| SCHEMBL21840525 | 0.74 | LDHA (0.58) | ALDH1A1LDHA | |
| SCHEMBL25380017 | 0.73 | ALDH1A1 (0.45) | ALDH1A1KDM4EMAPTGAAHPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-110066278-B | Fused tricyclic compound and application thereof in medicines | 广东东阳光药业有限公司 | 2021-06-08 | — | — | CN | disclosed |