Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.42 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 4/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 4/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL21023833 | 0.97 | TRPV1 (0.40) | TRPV1NR3C2LRRK2GAAMAPK13 | |
| SCHEMBL19954622 | 0.87 | GAA (0.37) | TRPV1NR3C2LRRK2GAAKCNH2 | |
| SCHEMBL2685387 | 0.83 | NR3C2 (0.42) | TRPV1NR3C2GAAMAPK13MAPK12 | |
| SCHEMBL19954551 | 0.82 | TRPV1 (0.35) | TRPV1NR3C2LRRK2GAATGFBR1 | |
| SCHEMBL19954609 | 0.79 | TRPV1 (0.42) | TRPV1NR3C2LRRK2KCNH2 | |
| SCHEMBL21024096 | 0.79 | GAA (0.44) | TRPV1NR3C2GAAMAPK13MAPK12 | |
| SCHEMBL21023570 | 0.78 | NR3C2 (0.38) | TRPV1NR3C2GAAALDH1A1 | |
| SCHEMBL21023578 | 0.78 | MAPK13 (0.43) | TRPV1NR3C2LRRK2GAAMAPK13 | |
| SCHEMBL12912163 | 0.78 | GAA (0.43) | TRPV1NR3C2GAAMAPK13MAPK12 | |
| SCHEMBL19954668 | 0.77 | PLAT (0.36) | TRPV1NR3C2LRRK2PDE4BTGFBR1 |
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-3080087-B1 | N-SUBSTITUTED PYRAZOLYL GUANIDINE F1F0-ATPASE INHIBITORS AND THERAPEUTIC USES THEREOF | LYCERA CORP (US) | 2019-05-22 | — | — | EP | disclosed |