Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL1493080 | 0.87 | CYP3A4 (0.54) | CYP3A4GABRA1GABRB2TRPA1 | |
| SCHEMBL1161021 | 0.80 | CYP3A4 (0.47) | CYP3A4GABRA1GABRB2TRPA1 | |
| SCHEMBL4242346 | 0.80 | CYP3A4 (0.47) | CYP3A4GABRA1GABRB2TRPA1 | |
| SCHEMBL1133625 | 0.79 | CYP3A4 (0.46) | CYP3A4NOTUMGABRA1GABRB2TRPA1 | |
| SCHEMBL964183 | 0.79 | CYP3A4 (0.55) | CYP3A4GABRA1GABRB2TRPA1 | |
| SCHEMBL3453793 | 0.75 | CYP3A4 (0.46) | CYP3A4GABRA1GABRB2TRPA1 | |
| SCHEMBL93319 | 0.74 | CYP3A4 (0.52) | CYP3A4GABRA1GABRB2TRPA1 | |
| SCHEMBL25147648 | 0.73 | NOTUM (0.44) | NOTUM | |
| SCHEMBL11872591 | 0.72 | CYP3A4 (0.56) | CYP3A4GABRA1GABRB2TRPA1 | |
| SCHEMBL3399383 | 0.72 | CYP3A4 (0.73) | CYP3A4GABRA1GABRB2TRPA1 |
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-2010011917-A1 | SEH AND 11β-HSD1 DUAL INHIBITORS | GLAXOSMITHKLINE LLC (US) | 2010-01-28 | — | — | WO | disclosed |