Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | C5AR1 | P21730 | 2/20 | 0.42 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.32 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.32 |
| ▸ | ITGAL | P20701 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | NCF1 | P14598 | 1/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | PHGDH | O43175 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL30079304 | 0.80 | C5AR1 (0.41) | C5AR1PIK3CAALDH1A1LMNAMAPT | |
| SCHEMBL30079400 | 0.80 | C5AR1 (0.44) | C5AR1ITGB2ICAM1ITGAL | |
| SCHEMBL30079321 | 0.79 | SUV39H2 (0.35) | NFE2L2ALDH1A1LMNAMAPT | |
| SCHEMBL30079447 | 0.77 | ALDH1A1 (0.39) | C5AR1ALDH1A1LMNAMAPTHTT | |
| SCHEMBL31266352 | 0.70 | SLC2A1 (0.46) | LMNAMAPT | |
| SCHEMBL24246943 | 0.69 | SLC22A12 (0.44) | SLC22A12NFE2L2 | |
| SCHEMBL9280550 | 0.68 | SLC22A12 (0.40) | SLC22A12NFE2L2 | |
| SCHEMBL13415859 | 0.68 | SLC22A12 (0.40) | SLC22A12NFE2L2ALDH1A1 | |
| SCHEMBL1369593 | 0.67 | EPHX2 (0.66) | HSD11B1LMNAMAPTHTT | |
| SCHEMBL677137 | 0.66 | SLC22A12 (0.40) | SLC22A12NFE2L2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3737684-B1 | 2,4,6,7-TETRAHYDRO-PYRAZOLO[4,3-D]PYRIMIDIN-5-ONE DERIVATIVES AND RELATED COMPOUNDS AS C5A RECEPTOR MODULATORS FOR TREATING VASCULITIS AND INFLAMMATORY DISEASES | IDORSIA PHARMACEUTICALS LTD (CH) | 2022-11-16 | — | — | EP | disclosed |