Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC13A5 | Q86YT5 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 9/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 2/20 | 0.39 |
| ▸ | PPARA | Q07869 | 2/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6529691 | 0.94 | SLC13A5 (0.43) | SLC13A5CYP2D6PTPN11 | |
| SCHEMBL6530516 | 0.93 | SLC13A5 (0.53) | SLC13A5NR1H4 | |
| SCHEMBL6530994 | 0.92 | S1PR1 (0.43) | SLC13A5GGPS1PTPN11 | |
| SCHEMBL6502428 | 0.85 | FFAR1 (0.44) | SLC13A5KCNH2 | |
| SCHEMBL6527018 | 0.84 | RARB (0.41) | PPARGPPARA | |
| SCHEMBL6506651 | 0.83 | S1PR1 (0.45) | PTPN11 | |
| SCHEMBL6528501 | 0.82 | CTSA (0.38) | SLC13A5NR1H4 | |
| SCHEMBL6528902 | 0.81 | MMP3 (0.38) | SLC13A5 | |
| SCHEMBL6529144 | 0.81 | S1PR1 (0.45) | SLC13A5PTPN11 | |
| SCHEMBL6528237 | 0.80 | S1PR1 (0.57) | SLC13A5PTPN11 |
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-2005014525-A2 | BI-ARYL COMPOUND HAVING IMMUNOSUPPRESSIVE ACTIVITY | MITSUBISHI PHARMA CORPORATION (JP) | 2005-02-17 | — | — | WO | disclosed |