Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | RHOC | P08134 | 1/20 | 0.34 |
| ▸ | RHOA | P61586 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | FABP4 | P15090 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | PPARA | Q07869 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9905331 | 1.00 | HPGD (0.35) | HPGDALDH1A1MAPTTP53ADORA2A | |
| SCHEMBL9905169 | 0.91 | NTRK1 (0.36) | HPGDALDH1A1MAPTTP53ADORA2A | |
| SCHEMBL9905171 | 0.91 | NTRK1 (0.36) | HPGDALDH1A1MAPTTP53ADORA2A | |
| SCHEMBL17088575 | 0.87 | ROCK2 (0.37) | HPGDMAPTTP53ROCK2ROCK1 | |
| SCHEMBL9921096 | 0.85 | MEN1 (0.48) | HPGDALDH1A1MAPTTDP1HDAC3 | |
| SCHEMBL9920875 | 0.82 | RAB9A (0.35) | HPGDMAPTRHOCRHOAHDAC6 | |
| SCHEMBL17088583 | 0.82 | EPHX2 (0.46) | ROCK2ROCK1PPARGEPHX2HDAC3 | |
| SCHEMBL9920877 | 0.79 | MEN1 (0.36) | ALDH1A1MAPTHDAC6RAB9ACYP1A2 | |
| SCHEMBL17509141 | 0.79 | MEN1 (0.36) | ALDH1A1MAPTHDAC6RAB9ACYP1A2 | |
| SCHEMBL9921075 | 0.79 | MAPT (0.34) | MAPTTP53LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2648511-A1 | PYRAZOLYL GUANIDINE F1F0-ATPASE INHIBITORS AND THERAPEUTIC USES THEREOF | Lycera Corporation (US) | 2013-10-16 | — | — | EP | disclosed |
| WO-2012078874-A1 | PYRAZOLYL GUANIDINE F1F0-ATPASE INHIBITORS AND THERAPEUTIC USES THEREOF | LYCERA CORPORATION (US) | 2012-06-14 | — | — | WO | disclosed |