Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CFTR | P13569 | 1/20 | 0.37 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 2/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2991093 | 0.89 | TAS2R14 (0.40) | ALDH1A1CYP1A2CYP2C9CYP2C19CFTR | |
| SCHEMBL12201211 | 0.80 | KDM4E (0.43) | ALDH1A1HPGDCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL5557325 | 0.76 | NPSR1 (0.48) | ALDH1A1HPGDKMT2AMEN1CYP1A2 | |
| SCHEMBL13500100 | 0.75 | CFTR (0.48) | CA1CA2CA9PTPN5KMT2A | |
| SCHEMBL2388309 | 0.73 | TAS2R14 (0.35) | ALDH1A1HPGDPTPN5EPHX2KMT2A | |
| SCHEMBL2388410 | 0.73 | CFTR (0.63) | ALDH1A1HPGDKMT2AMEN1CYP1A2 | |
| SCHEMBL26109138 | 0.73 | HTT (0.34) | ALDH1A1HPGDPTPN5EPHX2KMT2A | |
| SCHEMBL27703451 | 0.73 | CA1 (0.51) | CA1CA2CA9ALDH1A1HPGD | |
| SCHEMBL1433160 | 0.72 | RAB9A (0.48) | CA1CA2CA9PTPN5EPHX2 | |
| SCHEMBL30984296 | 0.72 | EPHX2 (0.41) | CA1CA2CA9ALDH1A1HPGD |
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-116836157-A | Oxadiazole derivative and preparation method and application thereof | 星希尔生物科技(上海)有限公司 | 2023-10-03 | — | — | CN | disclosed |
| WO-2023179366-A1 | OXADIAZOLE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF | 星希尔生物科技(上海)有限公司 | 2023-09-28 | — | — | WO | disclosed |