Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABBR2 | O75899 | 1/20 | 0.41 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.37 |
| ▸ | DAO | P14920 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | WRN | Q14191 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3615972 | 0.81 | GABBR2 (0.44) | GABBR2GABBR1POLBALDH1A1HPGD | |
| SCHEMBL8028596 | 0.81 | GABBR2 (0.41) | GABBR2GABBR1POLBALDH1A1HPGD | |
| SCHEMBL16664426 | 0.80 | ALOX5 (0.44) | POLBALDH1A1HPGDDAOKMT2A | |
| SCHEMBL2481845 | 0.80 | ALOX5 (0.44) | POLBALDH1A1HPGDDAOKMT2A | |
| Hydrochloric Acid SCHEMBL2819034 | 0.79 | GABBR2 (0.43) | GABBR2GABBR1POLBALDH1A1HPGD | |
| SCHEMBL17459302 | 0.79 | CES2 (0.38) | POLBALDH1A1HPGDDAOKMT2A | |
| SCHEMBL23972469 | 0.77 | GABBR2 (0.50) | GABBR2GABBR1POLBALDH1A1HPGD | |
| SCHEMBL8028534 | 0.77 | GABBR2 (0.38) | GABBR2GABBR1POLBALDH1A1HPGD | |
| SCHEMBL13701476 | 0.73 | SLC6A3 (0.52) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL11791477 | 0.71 | GABBR2 (0.45) | GABBR2GABBR1POLBALDH1A1F2 |
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-2016012333-A1 | PESTICIDAL COMPOUNDS | SYNGENTA PARTICIPATIONS AG (CH) | 2016-01-28 | — | — | WO | disclosed |