Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.39 |
| ▸ | HPGD | P15428 | 6/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.34 |
| ▸ | CASP1 | P29466 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | CASP7 | P55210 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25176694 | 1.00 | ALDH1A1 (0.39) | ALDH1A1KDM4EHSD17B10HPGDL3MBTL1 | |
| SCHEMBL25176693 | 1.00 | ALDH1A1 (0.39) | ALDH1A1KDM4EHSD17B10HPGDL3MBTL1 | |
| SCHEMBL25118112 | 0.79 | ALDH1A1 (0.39) | ALDH1A1KDM4EHSD17B10HPGDL3MBTL1 | |
| SCHEMBL25505138 | 0.75 | KDM4E (0.44) | ALDH1A1KDM4EHSD17B10HPGDL3MBTL1 | |
| SCHEMBL25118135 | 0.74 | KDM4E (0.43) | ALDH1A1KDM4EHSD17B10HPGDL3MBTL1 | |
| SCHEMBL30309824 | 0.73 | ALDH1A1 (0.34) | ALDH1A1KDM4EHSD17B10HPGDL3MBTL1 | |
| SCHEMBL25839563 | 0.73 | ALDH1A1 (0.34) | ALDH1A1KDM4EHSD17B10HPGDL3MBTL1 | |
| SCHEMBL25118141 | 0.73 | ALDH1A1 (0.33) | ALDH1A1KDM4EHSD17B10HPGDL3MBTL1 | |
| SCHEMBL25839766 | 0.73 | ALDH1A1 (0.33) | ALDH1A1KDM4EHSD17B10HPGDL3MBTL1 | |
| SCHEMBL25839690 | 0.72 | JAK2 (0.35) | ALDH1A1KDM4EHSD17B10HPGDL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023078267-A1 | AMINO-CONTAINING MACROCYCLIC COMPOUND AS PROTEIN KINASE MODULATOR | 赛诺哈勃药业（成都）有限公司 | 2023-05-11 | — | — | WO | disclosed |
| CN-116063326-A | Amino-containing macrocyclic compounds as protein kinase modulators | 赛诺哈勃药业（成都）有限公司 | 2023-05-05 | — | — | CN | disclosed |