Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL400236 | 0.81 | IDO1 (0.46) | IDO1TRPA1ALDH1A1TSHR | |
| SCHEMBL642402 | 0.81 | IDO1 (0.40) | IDO1TRPA1ALDH1A1TSHR | |
| SCHEMBL16958713 | 0.78 | PTGS2 (0.32) | IDO1 | |
| SCHEMBL16955115 | 0.75 | POLB (0.33) | IDO1 | |
| SCHEMBL1045848 | 0.74 | — | — | |
| SCHEMBL16951374 | 0.73 | GABRA1 (0.33) | — | |
| SCHEMBL16955109 | 0.72 | NPC1 (0.42) | — | |
| SCHEMBL24661052 | 0.70 | IDO1 (0.38) | IDO1TRPA1ALDH1A1TSHR | |
| SCHEMBL9616495 | 0.70 | IDO1 (0.38) | IDO1TRPA1ALDH1A1TSHR | |
| SCHEMBL671058 | 0.70 | IDO1 (0.34) | IDO1TRPA1ALDH1A1TSHR |
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-105189508-B | Naphthenic base nitrile Pyrazolopyridine ketone as JANUS kinase inhibitor | 默沙东公司 | 2018-11-23 | — | — | CN | disclosed |