Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 1/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.40 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28046490 | 0.89 | IDO1 (0.48) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL10405701 | 0.89 | IDO1 (0.48) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL10385269 | 0.85 | FFAR1 (0.44) | FFAR1PTGS2CHRNB2CHRNA4 | |
| SCHEMBL16191251 | 0.83 | IDO1 (0.44) | — | |
| SCHEMBL24864983 | 0.81 | LMNA (0.42) | FFAR1PTGS2 | |
| SCHEMBL10383557 | 0.81 | FFAR1 (0.41) | FFAR1PTGS2CYP17A1 | |
| SCHEMBL16191052 | 0.81 | IDO1 (0.42) | — | |
| SCHEMBL7823538 | 0.80 | GAA (0.57) | — | |
| SCHEMBL29054036 | 0.80 | GAA (0.52) | — | |
| SCHEMBL29054020 | 0.78 | GAA (0.55) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113072420-B | 2-aryl substituted gem-difluoro cyclobutane compounds and preparation method thereof | 中山大学 | 2022-05-20 | — | — | CN | disclosed |
| CN-113072420-A | 2-aryl substituted gem-difluoro cyclobutane compounds and preparation method thereof | 中山大学 | 2021-07-06 | — | — | CN | disclosed |