Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 4/20 | 0.75 |
| ▸ | ESR1 | P03372 | 3/20 | 0.75 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.75 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.75 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.75 |
| ▸ | AHR | P35869 | 3/20 | 0.75 |
| ▸ | ABL1 | P00519 | 2/20 | 0.75 |
| ▸ | TTR | P02766 | 2/20 | 0.75 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.75 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.75 |
| ▸ | BCR | P11274 | 2/20 | 0.75 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.75 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.75 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.75 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.75 |
| ▸ | TUBB | P07437 | 1/20 | 0.75 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.75 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.75 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.75 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.75 |
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 | |
|---|---|---|---|---|
| SCHEMBL6470139 | 0.92 | NFE2L2 (0.74) | NQO2ESR1CYP1A1PTGS2CYP1B1 | |
| SCHEMBL6470143 | 0.92 | NFE2L2 (0.74) | NQO2ESR1CYP1A1PTGS2CYP1B1 | |
| SCHEMBL6461623 | 0.92 | NFE2L2 (0.74) | NQO2ESR1CYP1A1PTGS2CYP1B1 | |
| SCHEMBL28901331 | 0.87 | KDM4E (0.67) | NQO2ESR1CYP1A1PTGS2CYP1B1 | |
| SCHEMBL3758141 | 0.86 | CYP1A1 (0.91) | NQO2ESR1CYP1A1PTGS2CYP1B1 | |
| Trismethoxyresveratrol SCHEMBL918740 | 0.86 | CYP1A1 (1.00) | NQO2ESR1CYP1A1PTGS2CYP1B1 | |
| 8Z-3,4',5-Trimethoxystilbene SCHEMBL1006207 | 0.86 | CYP1A1 (1.00) | NQO2ESR1CYP1A1PTGS2CYP1B1 | |
| Trismethoxyresveratrol SCHEMBL918739 | 0.86 | CYP1A1 (1.00) | NQO2ESR1CYP1A1PTGS2CYP1B1 | |
| SCHEMBL13443549 | 0.86 | CYP1A1 (0.91) | NQO2ESR1CYP1A1PTGS2CYP1B1 | |
| SCHEMBL6463507 | 0.85 | NQO2 (1.00) | NQO2ESR1CYP1A1PTGS2CYP1B1 |
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-3283459-A1 | MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO | Dow Agrosciences LLC (US) | 2018-02-21 | — | — | EP | disclosed |
| WO-2016168059-A1 | MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2016-10-20 | — | — | WO | disclosed |