Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 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 | |
|---|---|---|---|---|
| SCHEMBL31457232 | 0.79 | ESR2 (0.47) | ESR2TLR8CYP2A6GSK3AGSK3B | |
| SCHEMBL17731486 | 0.79 | ESR2 (0.47) | ESR2TLR8CYP2A6GSK3AGSK3B | |
| SCHEMBL20549167 | 0.78 | ESR2 (0.43) | ESR2TLR8CYP2A6GSK3AGSK3B | |
| SCHEMBL17802506 | 0.78 | CYP11B2 (0.50) | ESR2TLR8CYP2A6GSK3AGSK3B | |
| SCHEMBL31457215 | 0.77 | ESR2 (0.49) | ESR2TLR8ADORA3HTTMAPT | |
| SCHEMBL17802507 | 0.77 | ESR2 (0.49) | ESR2TLR8ADORA3HTTMAPT | |
| SCHEMBL20548985 | 0.76 | ESR2 (0.45) | ESR2TLR8CYP2A6ADORA3HTT | |
| SCHEMBL19328774 | 0.76 | MKNK1 (0.46) | ESR2TLR8ADORA3KDM4EALDH1A1 | |
| SCHEMBL30872907 | 0.76 | ESR2 (0.45) | ESR2TLR8CYP2A6ADORA3HTT | |
| SCHEMBL31692742 | 0.76 | ESR2 (0.45) | ESR2TLR8CYP2A6GSK3AGSK3B |
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-3044220-B1 | HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES | FMC CORP (US) | 2018-11-07 | — | — | EP | claimed |