Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TUBB1 | Q9H4B7 | 4/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 8/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 7/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 5/20 | 0.42 |
| ▸ | AHR | P35869 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | TTR | P02766 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | BCR | P11274 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | NQO2 | P16083 | 1/20 | 0.37 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.37 |
| ▸ | TUBB | P07437 | 1/20 | 0.37 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.37 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.37 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20076653 | 0.83 | AHR (0.42) | TUBB1PTGS2PTGS1ALOX5AHR | |
| SCHEMBL8398290 | 0.77 | RELA (0.41) | TUBB1PTGS2PTGS1ALOX5AHR | |
| SCHEMBL8398293 | 0.77 | RELA (0.41) | TUBB1PTGS2PTGS1ALOX5AHR | |
| SCHEMBL18922660 | 0.76 | CYP1A1 (0.52) | TUBB1PTGS2PTGS1ALOX5AHR | |
| SCHEMBL22245425 | 0.76 | CYP1A1 (0.52) | TUBB1PTGS2PTGS1ALOX5AHR | |
| SCHEMBL22245413 | 0.76 | CYP1A1 (0.52) | TUBB1PTGS2PTGS1ALOX5AHR | |
| SCHEMBL18143833 | 0.73 | TUBB1 (0.68) | TUBB1PTGS2PTGS1ALOX5AHR | |
| SCHEMBL18143837 | 0.73 | TUBB1 (0.68) | TUBB1PTGS2PTGS1ALOX5AHR | |
| SCHEMBL13681555 | 0.73 | KDM4E (0.38) | TUBB1PTGS2PTGS1ALOX5CYP1A2 | |
| SCHEMBL8394059 | 0.70 | KDM4E (0.57) | TUBB1PTGS2PTGS1ALOX5AHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3283459-B1 | MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2019-05-22 | — | — | EP | disclosed |