Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 5/20 | 0.59 |
| ▸ | THRA | P10827 | 1/20 | 0.59 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.40 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.40 |
| ▸ | TYMS | P04818 | 1/20 | 0.39 |
| ▸ | NCEH1 | Q6PIU2 | 3/20 | 0.36 |
| ▸ | PPARA | Q07869 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 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 | |
|---|---|---|---|---|
| SCHEMBL31536946 | 0.87 | THRB (0.72) | THRBTHRALTB4RLTB4R2PPARA | |
| SCHEMBL4596012 | 0.85 | THRB (0.78) | THRBTHRALTB4RLTB4R2TYMS | |
| SCHEMBL27863247 | 0.84 | THRB (0.60) | THRBTHRATYMSPPARAPPARG | |
| SCHEMBL27423807 | 0.84 | THRB (0.60) | THRBTHRALTB4RLTB4R2TYMS | |
| SCHEMBL1838058 | 0.82 | LTB4R (0.46) | THRBTHRALTB4RLTB4R2NCEH1 | |
| SCHEMBL146450 | 0.80 | THRB (0.70) | THRBTHRATYMSPTGS2KDM4E | |
| SCHEMBL18985524 | 0.80 | THRB (0.55) | THRBTHRALTB4RLTB4R2TYMS | |
| SCHEMBL1838821 | 0.79 | LTB4R (0.44) | THRBTHRALTB4RLTB4R2NCEH1 | |
| SCHEMBL9568523 | 0.79 | THRB (0.54) | THRBTHRALTB4RLTB4R2TYMS | |
| SCHEMBL9418357 | 0.77 | THRB (0.55) | THRBTHRALTB4RLTB4R2TYMS |
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 |
|---|---|---|---|---|---|---|---|
| CN-101351449-A | Nitroxyl compound, and polymerization inhibitor composition using same | ADEKA CORP (JP) | 2009-01-21 | — | — | CN | disclosed |