Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 7/20 | 0.48 |
| ▸ | TDO2 | P48775 | 7/20 | 0.48 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.43 |
| ▸ | MAP2 | P11137 | 1/20 | 0.39 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.38 |
| ▸ | RHEB | Q15382 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.34 |
| ▸ | GPR17 | Q13304 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 2/20 | 0.33 |
| ▸ | CCNC | P24863 | 1/20 | 0.32 |
| ▸ | CDK8 | P49336 | 1/20 | 0.32 |
| ▸ | EIF4A3 | P38919 | 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 | |
|---|---|---|---|---|
| SCHEMBL29063246 | 0.89 | MAP2K1 (0.49) | IDO1TDO2MAP2K1HRH4MAP2 | |
| SCHEMBL29063177 | 0.88 | IDO1 (0.54) | IDO1TDO2MAP2K1HRH4MAP2 | |
| SCHEMBL22396294 | 0.85 | IDO1 (0.65) | IDO1TDO2HRH4RHEBGPR17 | |
| SCHEMBL20504672 | 0.81 | IDO1 (0.48) | IDO1TDO2MAP2K1HRH4MAP2 | |
| SCHEMBL29062921 | 0.81 | IDO1 (0.48) | IDO1TDO2MAP2K1HRH4MAP2 | |
| SCHEMBL22620603 | 0.80 | XDH (0.50) | IDO1TDO2HRH4 | |
| SCHEMBL20505200 | 0.77 | KDM4E (0.57) | IDO1TDO2HRH4BRD4 | |
| SCHEMBL30310687 | 0.77 | KDM4E (0.57) | IDO1TDO2HRH4BRD4 | |
| SCHEMBL28455876 | 0.77 | ALOX15 (0.45) | IDO1TDO2HRH4 | |
| SCHEMBL21724765 | 0.75 | HRH4 (0.58) | IDO1TDO2HRH4 |
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-110483366-B | Indole compound and preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2022-09-16 | — | — | CN | disclosed |