Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 2/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | BMP4 | P12644 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL31589696 | 0.84 | TSHR (0.43) | ALDH1A1KDM4EHPGDNPSR1HSD17B10 | |
| SCHEMBL20399729 | 0.80 | RET (0.50) | — | |
| SCHEMBL30931991 | 0.79 | HAT1 (0.44) | ALDH1A1KDM4EL3MBTL1KDR | |
| Hydrochloric Acid SCHEMBL29516619 | 0.79 | USP30 (0.49) | — | |
| Hydrochloric Acid SCHEMBL30363088 | 0.79 | USP30 (0.49) | — | |
| SCHEMBL31589899 | 0.78 | RET (0.46) | ALDH1A1KDM4ETSHRGAAL3MBTL1 | |
| SCHEMBL30931984 | 0.77 | CREBBP (0.43) | — | |
| SCHEMBL30931974 | 0.77 | USP30 (0.43) | — | |
| SCHEMBL30932023 | 0.77 | KDM5A (0.39) | — | |
| SCHEMBL31589635 | 0.77 | RET (0.36) | ALDH1A1KDM4E |
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-113387947-B | Pyrazolopyridine derivatives that modulate estrogen receptor synthesis activity | 中国科学院成都生物研究所 | 2022-07-01 | — | — | CN | disclosed |