Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 4/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2900510 | 0.84 | HCAR1 (0.42) | HCAR1HSD11B1SCN9AOPRM1NR3C2 | |
| SCHEMBL2900034 | 0.81 | NPC1 (0.44) | CYP17A1OPRM1 | |
| SCHEMBL2903047 | 0.79 | ALDH1A1 (0.34) | HCAR1OPRM1 | |
| SCHEMBL2897911 | 0.79 | IDO1 (0.37) | HCAR1CYP17A1HSD11B1CHRM5IDO1 | |
| SCHEMBL2900638 | 0.74 | HCAR1 (0.35) | HCAR1HSD11B1 | |
| SCHEMBL1906253 | 0.71 | ALDH1A1 (0.40) | MGLLNR3C1PGR | |
| SCHEMBL16927593 | 0.70 | CYP17A1 (0.38) | CYP17A1OPRM1 | |
| SCHEMBL2027889 | 0.69 | MYC (0.42) | HCAR1HSD11B1THRBPIK3CAP2RX7 | |
| SCHEMBL1902421 | 0.69 | FAAH (0.42) | CYP17A1THRBIDO1MGLL | |
| SCHEMBL2350243 | 0.68 | KCNN4 (0.41) | HCAR1SCN9AMGLL |
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-2236505-A1 | Acylated aminopyridines and pyridazines as insecticides | Bayer CropScience AG (DE) | 2010-10-06 | — | — | EP | disclosed |