Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 2/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | PRKCA | P17252 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL27541532 | 0.98 | CNR2 (0.38) | CNR2CNR1PRKCATDP1 | |
| SCHEMBL27856421 | 0.85 | TDP1 (0.39) | CNR2CNR1PRKCATDP1 | |
| SCHEMBL27546682 | 0.80 | KDM4C (0.35) | CNR2PRKCATDP1 | |
| SCHEMBL27707300 | 0.78 | — | — | |
| SCHEMBL15746523 | 0.78 | — | — | |
| SCHEMBL28267133 | 0.78 | TSHR (0.31) | — | |
| SCHEMBL18030760 | 0.77 | TSHR (0.34) | TDP1 | |
| Ammonia Solution, Strong SCHEMBL28111373 | 0.76 | EPHX1 (0.44) | CNR2 | |
| SCHEMBL25155019 | 0.75 | PRMT3 (0.34) | — | |
| SCHEMBL19611882 | 0.75 | — | — |
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-105008370-A | TRICYCLIC COMPOUNDS AS CFTR INHIBITORS | NOVARTIS AG | 2015-10-28 | — | — | CN | disclosed |