Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.51 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | METAP2 | P50579 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19181823 | 0.87 | NUDT1 (0.53) | NUDT1PSMB5MAOBNPC1RAB9A | |
| SCHEMBL19011016 | 0.79 | NUDT1 (0.48) | NUDT1MAOBNPC1RAB9AMEN1 | |
| SCHEMBL8281383 | 0.72 | NPC1 (0.55) | NUDT1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL12799818 | 0.72 | ALOX5 (0.50) | NUDT1MAOBMEN1KMT2AALDH1A1 | |
| SCHEMBL25587812 | 0.71 | HPGD (0.56) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL1636724 | 0.71 | AKR1B1 (0.39) | NUDT1MAOBNPC1RAB9AMEN1 | |
| SCHEMBL12593185 | 0.70 | ESR2 (0.46) | NUDT1PSMB5MAOBNPC1RAB9A | |
| SCHEMBL21157905 | 0.70 | NUDT1 (0.44) | NUDT1PSMB5MAOBNPC1RAB9A | |
| SCHEMBL17851236 | 0.70 | ALOX5 (0.48) | NUDT1MAOBNPC1RAB9AMEN1 | |
| SCHEMBL12799826 | 0.70 | ALOX5 (0.48) | NUDT1MAOBNPC1RAB9AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023065614-A1 | METAL COMPLEX, MIXTURE, COMPOSITION, AND ORGANIC ELECTRONIC COMPONENT | 广州华睿光电材料有限公司 | 2023-04-27 | — | — | WO | disclosed |