Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 2/20 | 0.45 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | PPARD | Q03181 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 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 | |
|---|---|---|---|---|
| SCHEMBL11549150 | 0.85 | WDR5 (0.43) | MAOBPPARGPPARDPPARAMAPT | |
| SCHEMBL11553618 | 0.83 | MAOB (0.41) | MAOBPPARAALDH1A1CYP1A2 | |
| SCHEMBL9727736 | 0.80 | CYP19A1 (0.48) | MAOBAOC3CA12CA1CA2 | |
| SCHEMBL11551596 | 0.75 | LMNA (0.39) | MAOBPPARGPPARDPPARAMAPT | |
| SCHEMBL11269815 | 0.74 | PPARG (0.44) | MAOBAOC3PPARGPPARDPPARA | |
| SCHEMBL11269821 | 0.74 | PPARG (0.44) | MAOBAOC3PPARGPPARDPPARA | |
| SCHEMBL5145798 | 0.73 | CA1 (0.52) | MAOBAOC3CA12CA1CA2 | |
| 1-Allyloxy-4-Methoxybenzene SCHEMBL2843640 | 0.71 | ALDH1A1 (0.57) | MAOBCA12CA1CA2CA7 | |
| SCHEMBL1951879 | 0.71 | ALDH1A1 (0.52) | MAOBAOC3CA12CA1CA2 | |
| SCHEMBL11852455 | 0.70 | HTT (0.50) | MAOBAOC3PPARGPPARDPPARA |
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 |
|---|---|---|---|---|---|---|---|
| US-4156725-A | MICROBIOCIDES | BURROUGHS WELLCOME CO. (US) | 1979-05-29 | — | — | US | disclosed |