Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | THRA | P10827 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.39 |
| ▸ | NPY2R | P49146 | 1/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.34 |
| ▸ | CTRC | Q99895 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24405911 | 0.89 | TAAR1 (0.35) | CYP2D6THRATHRBLIPGTAAR1 | |
| SCHEMBL19980344 | 0.83 | NPY2R (0.40) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL12809949 | 0.82 | MGLL (0.37) | CYP2D6TAAR1 | |
| SCHEMBL14840424 | 0.80 | LIPG (0.44) | CYP3A4CYP2D6CYP2C9LIPGNPY2R | |
| SCHEMBL2903423 | 0.80 | LIPG (0.48) | CYP3A4CYP2D6CYP2C9LIPGNPY2R | |
| SCHEMBL23008863 | 0.79 | TYR (0.37) | CYP3A4THRATHRBCTRCTYR | |
| SCHEMBL23009106 | 0.78 | TDP1 (0.35) | CYP2D6CYP2C9CTRC | |
| SCHEMBL14839969 | 0.77 | LIPG (0.46) | CYP3A4CYP2D6CYP2C9LIPGNPY2R | |
| SCHEMBL5499862 | 0.74 | LIPG (0.56) | THRATHRBLIPGNR1H2NR1H3 | |
| SCHEMBL5223768 | 0.74 | LIPG (0.56) | THRATHRBLIPGNR1H2NR1H3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2956452-B1 | HETEROCYCLIC AMIDES AS KINASE INHIBITORS | GLAXOSMITHKLINE IP DEV LTD (GB) | 2018-03-21 | — | — | EP | disclosed |
| WO-2017004500-A9 | BICYCLIC LACTAMS AND METHODS OF USE THEREOF | GENENTECH, INC. (US) | 2017-11-30 | — | — | WO | disclosed |