Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 5/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 5/20 | 0.39 |
| ▸ | APP | P05067 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21931868 | 0.92 | TSHR (0.35) | HSD17B1HSD17B2 | |
| SCHEMBL7252959 | 0.89 | APP (0.45) | APP | |
| SCHEMBL3469543 | 0.81 | — | — | |
| SCHEMBL4846145 | 0.80 | APP (0.30) | APP | |
| SCHEMBL590270 | 0.79 | CYP2E1 (0.40) | HSD17B1HSD17B2 | |
| SCHEMBL1253872 | 0.78 | — | — | |
| SCHEMBL11294003 | 0.77 | APP (0.54) | HSD17B2APP | |
| SCHEMBL1992492 | 0.77 | — | — | |
| SCHEMBL2905343 | 0.77 | HSD17B1 (0.53) | HSD17B1HSD17B2APP | |
| SCHEMBL30449321 | 0.76 | CYP1A1 (0.34) | — |
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-2013008951-A1 | ORGANIC DYE, DYE-SENSITIZED METAL OXIDE SEMICONDUCTOR ELECTRODE AND DYE-SENSITIZED SOLAR CELL | NATIONAL INSTITUTE FOR MATERIALS SCIENCE (JP) | 2013-01-17 | — | — | WO | disclosed |