Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 18/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30410851 | 0.89 | KDR (0.44) | KDM4EALDH1A1L3MBTL1 | |
| SCHEMBL30395140 | 0.82 | KDM4E (0.38) | KDM4EALDH1A1HTTNPSR1TDP1 | |
| SCHEMBL30184314 | 0.80 | NPC1 (0.43) | GPR119KDM4EALDH1A1TDP1 | |
| SCHEMBL30395415 | 0.79 | KDM4E (0.36) | GPR119KDM4EALDH1A1L3MBTL1 | |
| SCHEMBL30411359 | 0.78 | KDM4E (0.41) | KDM4EALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL30309838 | 0.77 | KDR (0.48) | — | |
| SCHEMBL30395534 | 0.75 | ALDH1A1 (0.41) | KDM4EALDH1A1L3MBTL1 | |
| SCHEMBL30184310 | 0.73 | MAPK13 (0.44) | KDM4EALDH1A1L3MBTL1 | |
| SCHEMBL30410437 | 0.72 | ALDH1A1 (0.39) | KDM4EALDH1A1HTTL3MBTL1 | |
| SCHEMBL25505138 | 0.72 | KDM4E (0.44) | KDM4EALDH1A1HTTNPSR1TDP1 |
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 |