Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 14/20 | 0.61 |
| ▸ | IDO1 | P14902 | 9/20 | 0.54 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL19249257 | 0.88 | TDO2 (0.51) | TDO2IDO1TRPV1 | |
| SCHEMBL22083865 | 0.87 | TDO2 (0.52) | TDO2IDO1 | |
| SCHEMBL19249229 | 0.84 | TDO2 (0.60) | TDO2IDO1ROCK2ROCK1 | |
| SCHEMBL19249350 | 0.78 | MRGPRX4 (0.36) | TDO2ROCK2ROCK1 | |
| SCHEMBL19249092 | 0.77 | TDO2 (1.00) | TDO2IDO1 | |
| SCHEMBL19249008 | 0.77 | TDO2 (0.74) | TDO2IDO1TRPV1 | |
| SCHEMBL22083958 | 0.75 | TDO2 (0.53) | TDO2IDO1 | |
| SCHEMBL19249225 | 0.75 | TDO2 (1.00) | TDO2IDO1 | |
| SCHEMBL19249005 | 0.73 | TDO2 (1.00) | TDO2IDO1 | |
| SCHEMBL19249010 | 0.72 | TDO2 (0.64) | TDO2IDO1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017133258-A1 | 1H-INDAZOLE DERIVATIVE AND USE THEREOF AS IDO INHIBITOR | 西华大学 | 2017-08-10 | — | — | WO | disclosed |