Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 2/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.33 |
| ▸ | PDE2A | O00408 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.31 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.31 |
| ▸ | WNT3A | P56704 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20839010 | 0.84 | PIM1 (0.42) | NOS1CYP11B2CYP11B1ROCK2ROCK1 | |
| SCHEMBL29911053 | 0.84 | PIM1 (0.42) | NOS1CYP11B2CYP11B1ROCK2ROCK1 | |
| SCHEMBL20848298 | 0.74 | CYP11B2 (0.38) | CYP11B2CYP11B1CYP2A6ROCK2ROCK1 | |
| SCHEMBL469153 | 0.72 | HCRTR1 (0.47) | CYP11B2CYP11B1HCRTR1HCRTR2BCHE | |
| SCHEMBL20846009 | 0.69 | PIM1 (0.37) | CYP11B2CYP11B1HCRTR1HCRTR2 | |
| SCHEMBL20845980 | 0.69 | PIK3CG (0.45) | CYP11B2CYP11B1HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL20843695 | 0.68 | NOS3 (0.39) | NOS1CYP11B2CYP11B1CYP2A6S1PR1 | |
| SCHEMBL3423606 | 0.67 | CYP2A6 (0.61) | CYP11B2CYP11B1CYP2A6S1PR1 | |
| SCHEMBL20839273 | 0.67 | CYP11B2 (0.38) | CYP11B2CYP11B1HCRTR1HCRTR2 | |
| SCHEMBL10133630 | 0.67 | LRRK2 (0.52) | NOS1CYP11B2CYP11B1ROCK2ROCK1 |
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-2019057723-A1 | HERBICIDALLY ACTIVE PYRIDYL-/PYRIMIDYL-PYRAZINE DERIVATIVES | SYNGENTA PARTICIPATIONS AG (CH) | 2019-03-28 | — | — | WO | disclosed |