Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | PPARD | Q03181 | 1/20 | 0.34 |
| ▸ | PPARA | Q07869 | 1/20 | 0.34 |
| ▸ | EGLN1 | Q9GZT9 | 2/20 | 0.33 |
| ▸ | PDE4A | P27815 | 3/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25160279 | 0.75 | MAPT (0.37) | EGLN1SMN1; SMN2ALDH1A1CYP3A4ACACB | |
| SCHEMBL20644563 | 0.75 | MAPT (0.37) | EGLN1SMN1; SMN2ALDH1A1CYP3A4ACACB | |
| SCHEMBL20644511 | 0.69 | MAPT (0.33) | EGLN1SMN1; SMN2ALDH1A1ACACBLMNA | |
| SCHEMBL25160757 | 0.69 | PPARG (0.50) | PPARGPPARDPPARASMN1; SMN2MEN1 | |
| SCHEMBL25160611 | 0.67 | PPARD (0.46) | PPARGPPARDPPARASMN1; SMN2MEN1 | |
| SCHEMBL10141627 | 0.67 | KDM2B (0.47) | LMNAHTR1A | |
| SCHEMBL20644514 | 0.67 | ACACB (0.32) | EGLN1SMN1; SMN2ACACBLMNA | |
| SCHEMBL26499325 | 0.66 | PPARD (0.46) | PPARGPPARDPPARASMN1; SMN2NPC1 | |
| SCHEMBL26499297 | 0.66 | MAPT (0.47) | PPARGPPARDPPARANPC1ALDH1A1 | |
| SCHEMBL26499324 | 0.66 | PPARD (0.46) | PPARGPPARDPPARASMN1; SMN2NPC1 |
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-3397629-B1 | METALLOENZYME INHIBITOR COMPOUNDS | NQP 1598 LTD (KY) | 2023-04-19 | — | — | EP | disclosed |