Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 2/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8017449 | 0.73 | CA1 (0.36) | NOS1NOS3NOS2CTSKCA1 | |
| SCHEMBL12098467 | 0.70 | CHRM1 (0.38) | NOS1NOS3NOS2CTSKCA1 | |
| SCHEMBL15015760 | 0.70 | CHRM1 (0.40) | NOS1NOS3NOS2CTSKCA1 | |
| SCHEMBL12321026 | 0.70 | CTSK (0.36) | NOS1NOS3NOS2CTSKCA1 | |
| SCHEMBL27435004 | 0.69 | NOS1 (0.38) | NOS1NOS3NOS2CTSKCA2 | |
| SCHEMBL28732870 | 0.69 | CA1 (0.41) | NOS1NOS3NOS2CTSKCA1 | |
| SCHEMBL14275185 | 0.69 | NOS1 (0.36) | NOS1NOS3NOS2CA1CA2 | |
| SCHEMBL23151921 | 0.68 | NOS1 (0.39) | NOS1NOS3NOS2CTSKCA1 | |
| Methylamine SCHEMBL28388761 | 0.68 | NOS1 (0.39) | NOS1NOS3NOS2CTSKCA1 | |
| SCHEMBL30571827 | 0.67 | CHRM1 (0.38) | NOS1NOS3NOS2CTSKCA1 |
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-105085310-A | New synthesis method of telaprevir intermediate | CHONGQING HUIZHI PHARMACEUTICAL RES INST CO LTD | 2015-11-25 | — | — | CN | disclosed |