Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 16/20 | 0.41 |
| ▸ | TDO2 | P48775 | 6/20 | 0.41 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22413496 | 0.78 | IDO1 (0.45) | IDO1TDO2GPBAR1HSP90AA1HSP90AB1 | |
| SCHEMBL20829244 | 0.76 | HTR3E (0.39) | — | |
| SCHEMBL20829593 | 0.69 | CYP19A1 (0.32) | — | |
| SCHEMBL23586118 | 0.68 | GPBAR1 (0.41) | IDO1TDO2GPBAR1HSP90AA1HSP90AB1 | |
| SCHEMBL17651970 | 0.68 | GPBAR1 (0.41) | IDO1GPBAR1HSP90AA1HSP90AB1 | |
| SCHEMBL698045 | 0.68 | GPBAR1 (0.41) | IDO1TDO2GPBAR1HSP90AA1HSP90AB1 | |
| SCHEMBL22270186 | 0.68 | IDO1 (0.51) | IDO1TDO2GPBAR1HSP90AA1HSP90AB1 | |
| SCHEMBL7930812 | 0.66 | GPR3 (0.46) | — | |
| SCHEMBL18157866 | 0.65 | IDO1 (0.58) | IDO1TDO2 | |
| SCHEMBL17651983 | 0.65 | TDO2 (0.62) | IDO1TDO2HSP90AA1HSP90AB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3686201-A1 | INFLUENZA VIRUS REPLICATION INHIBITOR AND USE THEREOF | Sunshine Lake Pharma Co., Ltd. (CN) | 2020-07-29 | — | — | EP | disclosed |
| WO-2019052565-A1 | INFLUENZA VIRUS REPLICATION INHIBITOR AND USE THEREOF | 广东东阳光药业有限公司 | 2019-03-21 | — | — | WO | disclosed |