Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 11/20 | 0.60 |
| ▸ | WNT3A | P56704 | 11/20 | 0.60 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.59 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.59 |
| ▸ | FEN1 | P39748 | 1/20 | 0.59 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.55 |
| ▸ | CES2 | O00748 | 1/20 | 0.54 |
| ▸ | CES1 | P23141 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.49 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7244500 | 1.00 | CTNNB1 (0.60) | CTNNB1WNT3APTPN1ERCC5FEN1 | |
| SCHEMBL30089515 | 0.92 | CTNNB1 (0.68) | CTNNB1WNT3APTPN1ERCC5FEN1 | |
| SCHEMBL6383722 | 0.90 | PTPN1 (0.58) | CTNNB1WNT3APTPN1ERCC5FEN1 | |
| SCHEMBL14732971 | 0.85 | CTNNB1 (0.61) | CTNNB1WNT3APTPN1ERCC5FEN1 | |
| SCHEMBL9733599 | 0.83 | ALB (0.61) | CTNNB1WNT3APTPN1ERCC5FEN1 | |
| SCHEMBL5691811 | 0.82 | PTPN1 (0.72) | CTNNB1WNT3APTPN1ERCC5FEN1 | |
| SCHEMBL29062393 | 0.81 | CTNNB1 (0.53) | CTNNB1WNT3APTPN1ERCC5FEN1 | |
| SCHEMBL8616416 | 0.80 | CTNNB1 (0.56) | CTNNB1WNT3APTPN1ERCC5FEN1 | |
| SCHEMBL3121320 | 0.80 | ALDH1A1 (0.57) | CTNNB1WNT3APTPN1ERCC5FEN1 | |
| SCHEMBL8972179 | 0.80 | CTNNB1 (0.56) | CTNNB1WNT3APTPN1ERCC5FEN1 |
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-117510322-A | Preparation method of 4- (4-fluorophenyl) -4- (2-fluorophenyl) butyric acid | 湖南中南制药有限责任公司 | 2024-02-06 | — | — | CN | disclosed |