Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 6/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.38 |
| ▸ | NQO2 | P16083 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | TLR7 | Q9NYK1 | 6/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20839320 | 1.00 | PIK3CA (0.39) | PIK3CACYP11B2CYP11B1PIM1NQO2 | |
| SCHEMBL20849498 | 0.83 | CYP2A6 (0.38) | PIK3CACYP11B2CYP11B1TLR7 | |
| SCHEMBL20839258 | 0.81 | CYP11B2 (0.43) | CYP11B2CYP11B1 | |
| SCHEMBL29856016 | 0.81 | CYP11B2 (0.43) | CYP11B2CYP11B1 | |
| SCHEMBL25703918 | 0.79 | CYP11B2 (0.36) | PIK3CACYP11B2CYP11B1PIM1NQO2 | |
| SCHEMBL20839164 | 0.78 | NQO2 (0.34) | PIK3CACYP11B2CYP11B1PIM1NQO2 | |
| SCHEMBL29855887 | 0.78 | NQO2 (0.34) | PIK3CACYP11B2CYP11B1PIM1NQO2 | |
| SCHEMBL29855842 | 0.78 | CYP11B2 (0.36) | PIK3CACYP11B2CYP11B1PIM1TLR7 | |
| SCHEMBL20839319 | 0.78 | CYP11B2 (0.36) | PIK3CACYP11B2CYP11B1PIM1TLR7 | |
| SCHEMBL20839157 | 0.78 | ADK (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111372455-B | Herbicidally active pyridyl-/pyrimidinyl-pyrimidine derivatives | 先正达参股股份有限公司 | 2022-10-11 | — | — | CN | disclosed |