Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FABP3 | P05413 | 4/20 | 0.49 |
| ▸ | SNCA | P37840 | 1/20 | 0.49 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17290437 | 1.00 | FABP3 (0.49) | FABP3SNCAS1PR1KMT2AMEN1 | |
| SCHEMBL19423247 | 0.81 | FABP3 (0.60) | FABP3SNCAS1PR1KMT2AMEN1 | |
| SCHEMBL12003500 | 0.80 | AURKA (0.40) | FABP3SNCAKMT2AMEN1GRM5 | |
| SCHEMBL17290570 | 0.80 | MAPT (0.53) | FABP3KMT2AGRM5ALDH1A1LMNA | |
| SCHEMBL23403283 | 0.80 | FABP3 (0.49) | FABP3KMT2AMEN1ALDH1A1LMNA | |
| SCHEMBL28616979 | 0.78 | FABP3 (0.46) | FABP3SNCAS1PR1KMT2AMEN1 | |
| SCHEMBL16664821 | 0.78 | HSD11B1 (0.44) | KMT2AMEN1ALDH1A1MAPTTP53 | |
| SCHEMBL16112121 | 0.77 | ALDH1A1 (0.51) | FABP3SNCAKMT2AMEN1GRM5 | |
| SCHEMBL23401834 | 0.77 | ALDH1A1 (0.64) | KMT2AMEN1GRM5ALDH1A1LMNA | |
| SCHEMBL15778491 | 0.76 | KDM4C (0.55) | — |
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-3148972-A1 | PYRAZOLONE DERIVATIVES AS NITROXYL DONORS | Cardioxyl Pharmaceuticals Inc. (US) | 2017-04-05 | — | — | EP | disclosed |
| WO-2015183839-A1 | PYRAZOLONE DERIVATIVES AS NITROXYL DONORS | CARDIOXYL PHARMACEUTICALS, INC. (US) | 2015-12-03 | — | — | WO | disclosed |