Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 6/20 | 0.36 |
| ▸ | CA12 | O43570 | 5/20 | 0.35 |
| ▸ | CA2 | P00918 | 5/20 | 0.35 |
| ▸ | CA9 | Q16790 | 5/20 | 0.35 |
| ▸ | CA1 | P00915 | 4/20 | 0.35 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.35 |
| ▸ | KAT7 | O95251 | 2/20 | 0.35 |
| ▸ | KAT6A | Q92794 | 2/20 | 0.35 |
| ▸ | KAT6B | Q8WYB5 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | BRD2 | P25440 | 2/20 | 0.33 |
| ▸ | BRD3 | Q15059 | 2/20 | 0.33 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL30522048 | 0.85 | BRD4 (0.40) | CA4BRD4CA12CA2CA9 | |
| SCHEMBL30522043 | 0.82 | CA2 (0.38) | CA4BRD4CA12CA2CA9 | |
| SCHEMBL30522050 | 0.82 | CA4 (0.39) | CA4BRD4CA12CA2CA9 | |
| SCHEMBL30522049 | 0.81 | CA2 (0.40) | CA4BRD4CA12CA2CA9 | |
| SCHEMBL30522035 | 0.80 | BRD4 (0.39) | CA4BRD4CA12CA2CA9 | |
| SCHEMBL30522039 | 0.78 | CA4 (0.38) | CA4BRD4CA12CA2CA9 | |
| SCHEMBL30522040 | 0.78 | CA4 (0.38) | CA4BRD4CA12CA2CA9 | |
| SCHEMBL30522038 | 0.78 | CA2 (0.35) | CA4BRD4CA12CA2CA9 | |
| SCHEMBL30522045 | 0.78 | CA4 (0.38) | CA4BRD4CA12CA2CA9 | |
| SCHEMBL30522034 | 0.77 | HTT (0.44) | CA4CA12CA2CA9CA1 |
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-113651766-B | Isoxazole sulfonamide compound with BRD4 inhibitory activity, and preparation method and application thereof | 泰州职业技术学院 | 2023-08-18 | — | — | CN | disclosed |