Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA5 | P31644 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 2/20 | 0.37 |
| ▸ | SOS2 | Q07890 | 1/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | NQO1 | P15559 | 1/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.33 |
| ▸ | FEN1 | P39748 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | TRPV4 | Q9HBA0 | 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 | |
|---|---|---|---|---|
| SCHEMBL34469261 | 1.00 | GABRA5 (0.40) | GABRA5CTSKTRPV3CTSSSOS2 | |
| SCHEMBL2522651 | 0.80 | TRPV3 (0.45) | TRPV3ALOX5AP | |
| SCHEMBL29530386 | 0.79 | NQO1 (0.44) | GABRA5CTSKSOS2MGLLNQO1 | |
| SCHEMBL874972 | 0.79 | NQO1 (0.44) | GABRA5CTSKSOS2MGLLNQO1 | |
| SCHEMBL26750064 | 0.77 | NUDT1 (0.46) | GABRA5CTSKCTSSALOX5APFEN1 | |
| SCHEMBL2952806 | 0.74 | GABRA5 (0.49) | GABRA5CTSSMGLLNQO1 | |
| SCHEMBL14545220 | 0.72 | CCR1 (0.44) | GABRA5TRPV3ALOX5AP | |
| SCHEMBL995983 | 0.72 | SOS2 (0.50) | CTSKCTSSSOS2NQO1SRC | |
| SCHEMBL24305912 | 0.71 | MGLL (0.39) | GABRA5CTSKCTSSSOS2MGLL | |
| SCHEMBL2963175 | 0.71 | MGLL (0.47) | GABRA5SOS2MGLLSRC |
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-2013010453-A1 | CHEMOKING RECEPTOR ANTAGONISTS | ABBOTT LABORATORIES (US) | 2013-01-24 | — | — | WO | disclosed |