Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 4/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.50 |
| ▸ | NQO2 | P16083 | 1/20 | 0.50 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.48 |
| ▸ | BAX | Q07812 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.47 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.46 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL403667 | 0.83 | LTA4H (0.71) | LTA4HTSHRGSTP1NR1H2BAX | |
| SCHEMBL4340657 | 0.83 | ALDH1A1 (0.61) | TSHRNQO2ALDH1A1HPGDCYP2E1 | |
| Biphenyl SCHEMBL10838288 | 0.83 | LTA4H (0.71) | LTA4HTSHRGSTP1NR1H2BAX | |
| SCHEMBL4344550 | 0.83 | ALDH1A1 (0.61) | TSHRNQO2ALDH1A1HPGDCYP2E1 | |
| SCHEMBL21921128 | 0.83 | LTA4H (0.71) | LTA4HTSHRGSTP1NR1H2BAX | |
| SCHEMBL9190364 | 0.83 | LTA4H (0.71) | LTA4HTSHRGSTP1NR1H2BAX | |
| SCHEMBL28568726 | 0.83 | NPC1 (0.61) | LTA4HNQO2ALDH1A1HPGDCYP3A4 | |
| SCHEMBL76097 | 0.83 | CYP2E1 (0.58) | TSHRNQO2ALDH1A1HPGDCYP2E1 | |
| SCHEMBL3038241 | 0.82 | KDM4E (0.57) | GSTP1ALDH1A1HPGDCYP2E1CYP3A4 | |
| SCHEMBL31588897 | 0.80 | LTA4H (0.67) | LTA4HTSHRGSTP1NR1H2BAX |
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-118184606-A | Method for preparing 2, 5-disubstituted and 2,3, 5-trisubstituted furan skeleton derivative | 中国医学科学院药物研究所 | 2024-06-14 | — | — | CN | disclosed |