Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 18/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | TDO2 | P48775 | 1/20 | 0.31 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30632084 | 1.00 | IDO1 (0.61) | IDO1LMNATSHRNPSR1CYP3A4 | |
| SCHEMBL2515046 | 0.89 | IDO1 (0.59) | IDO1 | |
| SCHEMBL148261 | 0.87 | IDO1 (0.60) | IDO1CYP3A4CYP2C9TDO2IDO2 | |
| SCHEMBL30589086 | 0.87 | IDO1 (0.60) | IDO1CYP3A4CYP2C9TDO2IDO2 | |
| SCHEMBL6046627 | 0.87 | IDO1 (0.57) | IDO1 | |
| Iodide SCHEMBL145709 | 0.86 | IDO1 (0.59) | IDO1CYP3A4CYP2C9TDO2IDO2 | |
| Hydrochloric Acid SCHEMBL29609373 | 0.86 | IDO1 (0.59) | IDO1CYP3A4CYP2C9TDO2IDO2 | |
| Hydrochloric Acid SCHEMBL148937 | 0.86 | IDO1 (0.59) | IDO1CYP3A4CYP2C9TDO2IDO2 | |
| SCHEMBL20841189 | 0.86 | IDO1 (0.59) | IDO1TDO2IDO2 | |
| SCHEMBL29104822 | 0.86 | IDO1 (0.59) | IDO1IDO2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111116572-B | Oxadiazole derivative, preparation method and application thereof | 石药集团中奇制药技术（石家庄）有限公司 | 2023-10-27 | — | — | CN | disclosed |
| CN-111116572-A | Oxadiazole derivatives, their preparation and use | 石药集团中奇制药技术（石家庄）有限公司 | 2020-05-08 | — | — | CN | disclosed |
| WO-2018072697-A1 | OXADIAZOLE RING-CONTAINING COMPOUND, PREPARATION METHOD THEREFOR, AND INTERMEDIATE, COMPOSITE, AND APPLICATION THEREOF | 上海医药集团股份有限公司 | 2018-04-26 | — | — | WO | disclosed |