Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | PRCP | P42785 | 2/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL18009200 | 0.86 | CTSC (0.34) | CTSCHCAR2KEAP1NFE2L2PRCP | |
| SCHEMBL18009198 | 0.85 | HCAR2 (0.38) | CTSCHCAR2KEAP1NFE2L2 | |
| SCHEMBL18009201 | 0.83 | HCAR2 (0.39) | CTSCHCAR2KEAP1NFE2L2 | |
| SCHEMBL18009286 | 0.81 | HCAR2 (0.41) | CTSCHCAR2KEAP1NFE2L2 | |
| SCHEMBL18009276 | 0.81 | HCAR2 (0.41) | CTSCHCAR2KEAP1NFE2L2 | |
| SCHEMBL18009459 | 0.81 | CTSC (0.49) | CTSCDPP4 | |
| SCHEMBL18009447 | 0.80 | HCAR2 (0.34) | CTSCHCAR2KEAP1NFE2L2DPP4 | |
| SCHEMBL18009187 | 0.77 | HCAR2 (0.36) | CTSCHCAR2KEAP1NFE2L2 | |
| SCHEMBL18009452 | 0.76 | DPP4 (0.45) | CTSCDPP4 | |
| SCHEMBL18009456 | 0.74 | KEAP1 (0.32) | HCAR2KEAP1NFE2L2 |
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-2016127186-A1 | FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE | NGUYEN MARK QUANG (US) | 2016-08-11 | — | — | WO | disclosed |