Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 5/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 7/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | RHOC | P08134 | 1/20 | 0.36 |
| ▸ | RHOA | P61586 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16938619 | 0.92 | CNR1 (0.49) | CNR1MAPK1MAPTTP53THRB | |
| SCHEMBL412331 | 0.88 | CNR1 (0.52) | CNR1MAPK1MAPTTP53CNR2 | |
| SCHEMBL441170 | 0.88 | CNR1 (0.52) | CNR1MAPK1MAPTTP53CNR2 | |
| SCHEMBL411188 | 0.88 | CNR1 (0.52) | CNR1MAPK1MAPTTP53CNR2 | |
| SCHEMBL412122 | 0.84 | CNR1 (0.45) | CNR1MAPK1MAPTTP53THRB | |
| SCHEMBL444586 | 0.84 | CNR1 (0.45) | CNR1MAPK1MAPTTP53THRB | |
| SCHEMBL412095 | 0.79 | CNR1 (0.55) | CNR1MAPTTP53THRBCNR2 | |
| SCHEMBL411092 | 0.78 | CNR1 (0.55) | CNR1MAPTTP53THRBCNR2 | |
| SCHEMBL411182 | 0.78 | CNR1 (0.47) | CNR1MAPTTP53THRBCNR2 | |
| SCHEMBL470435 | 0.77 | CNR1 (0.44) | CNR1MAPK1CNR2 |
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-2012032018-A1 | HETEROARYLMETHYL AMIDES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-03-15 | — | — | WO | disclosed |