Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 3/20 | 0.60 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.47 |
| ▸ | CCR3 | P51677 | 1/20 | 0.45 |
| ▸ | ECE2 | P0DPD6 | 1/20 | 0.44 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | EP300 | Q09472 | 1/20 | 0.42 |
| ▸ | MEF2D | Q14814 | 1/20 | 0.42 |
| ▸ | SYK | P43405 | 1/20 | 0.42 |
| ▸ | AIMP2 | Q13155 | 1/20 | 0.42 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.41 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.41 |
| ▸ | ITGAL | P20701 | 2/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22605517 | 1.00 | HDAC3 (0.60) | HDAC3HDAC1HDAC2CCR3ECE2 | |
| SCHEMBL30317154 | 0.88 | HDAC3 (0.48) | HDAC3HDAC1HDAC2CCR3ECE2 | |
| SCHEMBL31285878 | 0.85 | MAPK1 (0.48) | HDAC3HDAC1HDAC2CCR3ECE2 | |
| SCHEMBL22605817 | 0.85 | HDAC3 (0.52) | HDAC3HDAC1HDAC2CCR3ECE2 | |
| SCHEMBL22587986 | 0.85 | MAPK1 (0.48) | HDAC3HDAC1HDAC2CCR3ECE2 | |
| SCHEMBL22588162 | 0.83 | HDAC3 (0.45) | HDAC3CCR3ECE2SYK | |
| SCHEMBL22605502 | 0.78 | HRH3 (0.51) | HDAC1HDAC2HRH3 | |
| SCHEMBL31285937 | 0.76 | MLNR (0.53) | SYKHRH3 | |
| SCHEMBL22588174 | 0.76 | MLNR (0.53) | SYKHRH3 | |
| SCHEMBL22588324 | 0.76 | KDM1A (0.45) | HDAC2 |
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-111848598-B | Heterocyclic compound, application thereof and composition containing same | 健艾仕生物医药有限公司 | 2024-12-10 | — | — | CN | disclosed |