Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA5 | P31644 | 7/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | CA2 | P00918 | 3/20 | 0.34 |
| ▸ | CA4 | P22748 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.32 |
| ▸ | TUBB | P07437 | 1/20 | 0.32 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL25044731 | 1.00 | GABRA5 (0.36) | GABRA5GABRG2GABRB3KCNH2ALDH1A1 | |
| SCHEMBL25044720 | 0.91 | HTT (0.36) | GABRA5GABRG2GABRB3KCNH2CA1 | |
| SCHEMBL30283031 | 0.91 | HTT (0.36) | GABRA5GABRG2GABRB3KCNH2CA1 | |
| SCHEMBL30282919 | 0.88 | L3MBTL1 (0.45) | GABRA5GABRG2GABRB3KCNH2ALDH1A1 | |
| SCHEMBL25044716 | 0.88 | L3MBTL1 (0.45) | GABRA5GABRG2GABRB3KCNH2ALDH1A1 | |
| SCHEMBL21623964 | 0.84 | GABRA5 (0.43) | GABRA5GABRG2GABRB3KCNH2RXRA | |
| SCHEMBL30282856 | 0.84 | GABRA5 (0.43) | GABRA5GABRG2GABRB3KCNH2RXRA | |
| SCHEMBL25045392 | 0.84 | RXRA (0.33) | GABRA5GABRG2GABRB3KCNH2RXRA | |
| SCHEMBL30283165 | 0.84 | RXRA (0.33) | GABRA5GABRG2GABRB3KCNH2RXRA | |
| SCHEMBL25045285 | 0.83 | RXRA (0.33) | GABRA5GABRG2GABRB3KCNH2RXRA |
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-115703765-B | Substituted triazole derivative, preparation method, pharmaceutical composition and application thereof | 上海赛默罗生物科技有限公司 | 2025-02-28 | — | — | CN | disclosed |
| CN-115703765-A | Substituted triazole derivative, preparation method, pharmaceutical composition and application thereof | 上海赛默罗生物科技有限公司 | 2023-02-17 | — | — | CN | disclosed |