Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 5/20 | 0.57 |
| ▸ | TDO2 | P48775 | 5/20 | 0.57 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
| ▸ | BRAF | P15056 | 1/20 | 0.44 |
| ▸ | PTK6 | Q13882 | 1/20 | 0.44 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.43 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.41 |
| ▸ | GRM4 | Q14833 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.40 |
| ▸ | CD38 | P28907 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ARNT | P27540 | 1/20 | 0.39 |
| ▸ | EPAS1 | Q99814 | 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 | |
|---|---|---|---|---|
| SCHEMBL29865062 | 1.00 | IDO1 (0.57) | IDO1TDO2CNR1BRAFPTK6 | |
| SCHEMBL29865364 | 0.77 | IDO1 (0.65) | IDO1TDO2CNR1BRAFPTK6 | |
| SCHEMBL28844721 | 0.77 | IDO1 (0.65) | IDO1TDO2CNR1BRAFPTK6 | |
| SCHEMBL27576872 | 0.76 | RAPGEF4 (0.53) | IDO1TDO2CNR1PTK6RAPGEF4 | |
| SCHEMBL29865339 | 0.75 | IDO1 (0.61) | IDO1TDO2CNR1PTK6RAPGEF4 | |
| SCHEMBL28844660 | 0.75 | IDO1 (0.61) | IDO1TDO2CNR1PTK6RAPGEF4 | |
| SCHEMBL28844663 | 0.74 | IDO1 (0.61) | IDO1TDO2CNR1BRAFPTK6 | |
| SCHEMBL29865020 | 0.74 | IDO1 (0.65) | IDO1TDO2CNR1BRAFPTK6 | |
| SCHEMBL29865028 | 0.74 | IDO1 (0.61) | IDO1TDO2CNR1BRAFPTK6 | |
| SCHEMBL28844773 | 0.74 | IDO1 (0.65) | IDO1TDO2CNR1BRAFPTK6 |
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 |