Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 2/20 | 0.44 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | PNMT | P11086 | 1/20 | 0.43 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | TDO2 | P48775 | 2/20 | 0.39 |
| ▸ | IDO2 | Q6ZQW0 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | BLM | P54132 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6141168 | 0.82 | ADRB2 (0.42) | ADRB2ADRB1CYP3A4CYP2D6NFKB1 | |
| SCHEMBL2163244 | 0.82 | ALDH1A1 (0.46) | ADRB2ADRB1CYP3A4CYP2D6NFKB1 | |
| SCHEMBL84509 | 0.77 | GABRA1 (0.50) | ADRB2ADRB1CYP3A4CYP2D6NFKB1 | |
| SCHEMBL12204154 | 0.77 | ADRB2 (0.48) | ADRB2ADRB1CYP3A4CYP2D6NFKB1 | |
| SCHEMBL29107358 | 0.76 | CXCL8 (0.46) | ADRB2ADRB1ALDH1A1AOC3CXCL8 | |
| SCHEMBL9729680 | 0.76 | LMNA (0.59) | CYP3A4LMNAALDH1A1TSHRIDO1 | |
| SCHEMBL1588934 | 0.75 | ADRB2 (0.47) | ADRB2ADRB1CYP3A4CYP2D6NFKB1 | |
| SCHEMBL13145152 | 0.75 | ADRB2 (0.47) | ADRB2ADRB1CYP3A4CYP2D6NFKB1 | |
| SCHEMBL136204 | 0.74 | ADRB2 (0.43) | ADRB2ADRB1CYP3A4CYP2D6NFKB1 | |
| SCHEMBL10079991 | 0.74 | HTT (0.40) | CYP3A4CYP1A2LMNAALDH1A1TSHR |
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-2012084678-A1 | NOVEL IMIDAZOLES USEFUL AS PLANT FUNGICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2012-06-28 | — | — | WO | disclosed |