Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90B1 | P14625 | 5/20 | 0.55 |
| ▸ | AHCY | P23526 | 7/20 | 0.53 |
| ▸ | TSHR | P16473 | 4/20 | 0.52 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.52 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.52 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL30744251 | 0.91 | ADORA3 (0.53) | HSP90B1AHCYADORA2BADORA3ADORA2A | |
| SCHEMBL29540000 | 0.80 | DOT1L (0.47) | HSP90B1AHCYTSHRADORA2BHSP90AA1 | |
| SCHEMBL4314015 | 0.80 | ADORA1 (0.61) | ADORA1 | |
| SCHEMBL24673147 | 0.80 | HSP90B1 (0.71) | HSP90B1AHCYTSHRADORA2BHSP90AA1 | |
| SCHEMBL29365543 | 0.80 | P2RY1 (0.55) | ADORA1 | |
| SCHEMBL22797658 | 0.80 | HSP90B1 (0.71) | HSP90B1AHCYTSHRADORA2BHSP90AA1 | |
| SCHEMBL22797654 | 0.80 | HSP90B1 (0.71) | HSP90B1AHCYTSHRADORA2BHSP90AA1 | |
| SCHEMBL22799204 | 0.79 | AHCY (0.55) | HSP90B1AHCYADORA2BADORA2AHIF1A | |
| SCHEMBL29540248 | 0.79 | DOT1L (0.47) | HSP90B1AHCYADORA2BHSP90AA1ADORA3 | |
| SCHEMBL16255813 | 0.79 | P2RY1 (0.52) | AHCYADORA2BADORA3ADORA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118256591-A | Cyclic peptide compound having high membrane permeability and library comprising same | 中外制药株式会社 | 2024-06-28 | — | — | CN | disclosed |
| CN-110869544-B | Cyclic peptide compound having high membrane permeability and library comprising same | 中外制药株式会社 | 2024-03-08 | — | — | CN | disclosed |