Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11774915 | 0.84 | ALDH1A1 (0.50) | ALDH1A1HPGDCYP2C19HTTHSD17B10 | |
| SCHEMBL11777592 | 0.83 | HRH3 (0.47) | ALDH1A1HPGDMAPTHTTHRH3 | |
| SCHEMBL11774317 | 0.81 | HRH3 (0.48) | ALDH1A1HPGDMAPK1MAPTHRH3 | |
| SCHEMBL11775033 | 0.81 | MAP4K4 (0.53) | ALDH1A1HPGDMAPK1MAPTHRH3 | |
| SCHEMBL11727405 | 0.78 | MAPT (0.51) | ALDH1A1HPGDMAPTHRH3HSD17B10 | |
| SCHEMBL11882783 | 0.74 | LMNA (0.55) | ALDH1A1TSHRHPGDMAPTALOX12 | |
| SCHEMBL11772719 | 0.72 | HRH3 (0.43) | ALDH1A1HPGDMAPTHRH3HSD17B10 | |
| SCHEMBL11772710 | 0.72 | HRH3 (0.43) | ALDH1A1HPGDMAPTHRH3HSD17B10 | |
| SCHEMBL11772598 | 0.71 | ALDH1A1 (0.44) | ALDH1A1TSHRHPGDMAPK1MAPT | |
| SCHEMBL11776797 | 0.71 | TGM2 (0.47) | ALDH1A1HPGDMAPTHRH3HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-3987171-A | QUINOXALINE FUNGICIDES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-10-19 | — | — | US | disclosed |