Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.42 |
| ▸ | TYR | P14679 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | GSR | P00390 | 1/20 | 0.39 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.39 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.38 |
| ▸ | CTSB | P07858 | 2/20 | 0.38 |
| ▸ | CTSH | P09668 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11421422 | 1.00 | GPR35 (0.42) | GPR35TYRTRPV1ESR1TSHR | |
| SCHEMBL28899639 | 1.00 | GPR35 (0.42) | GPR35TYRTRPV1ESR1TSHR | |
| SCHEMBL1123245 | 0.94 | GPR35 (0.45) | GPR35TRPV1TSHRCTSBCTSH | |
| SCHEMBL5588969 | 0.84 | TYR (0.46) | TYRESR1GSRTXNRD1KAT8 | |
| SCHEMBL5587233 | 0.84 | TYR (0.46) | TYRESR1GSRTXNRD1KAT8 | |
| SCHEMBL5590461 | 0.84 | TYR (0.46) | TYRESR1GSRTXNRD1KAT8 | |
| SCHEMBL5588658 | 0.84 | TYR (0.46) | TYRESR1GSRTXNRD1KAT8 | |
| SCHEMBL5587053 | 0.84 | TYR (0.46) | TYRESR1GSRTXNRD1KAT8 | |
| SCHEMBL5691196 | 0.82 | GPR35 (0.45) | GPR35TRPV1TSHRCTSBCTSH | |
| SCHEMBL30425872 | 0.82 | GPR35 (0.45) | GPR35TRPV1TSHRCTSBCTSH |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8557866-B2 | Isomeric mixtures of dinitro-octylphenyl esters and synergistic fungicidal mixtures therefrom | DOW AGROSCIENCES, LLC. (US) | 2013-10-15 | — | — | US | disclosed |
| EP-1830641-B1 | ISOMERIC MIXTURES OF DINITRO-OCTYLPHENYL ESTERS AND SYNERGISTIC FUNGICIDAL MIXTURES THEREFROM | DOW AGROSCIENCES LLC (US) | 2011-05-25 | — | — | EP | disclosed |
| CN-101060780-B | Isomeric mixtures of dinitro-octylphenyl esters and synergistic fungicidal mixtures therefrom | DOW AGROSCIENCES LLC | 2011-04-20 | — | — | CN | disclosed |
| US-20080255233-A1 | Isomeric mixtures of dinitro-octylphenyl esters and synergistic fungicidal mixtures therefrom | DOW AGROSCIENCES LLC (US) | 2008-10-16 | — | — | US | disclosed |
| CN-101060780-A | Isomeric mixtures of dinitro-octylphenyl esters and synergistic fungicidal mixtures therefrom | DOW AGROSCIENCES LLC (US) | 2007-10-24 | — | — | CN | disclosed |
| EP-1830641-A1 | ISOMERIC MIXTURES OF DINITRO-OCTYLPHENYL ESTERS AND SYNERGISTIC FUNGICIDAL MIXTURES THEREFROM | Dow AgroSciences LLC (US) | 2007-09-12 | — | — | EP | disclosed |
| WO-2006044460-A1 | ISOMERIC MIXTURES OF DINITRO-OCTYLPHENYL ESTERS AND SYNERGISTIC FUNGICIDAL MIXTURES THEREFROM | DOW AGROSCIENCES LLC (US) | 2006-04-27 | — | — | WO | disclosed |