Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | TNKS | O95271 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL28837166 | 1.00 | MAOB (0.50) | MAOBCA1CA2PTPN1ALDH1A1 | |
| SCHEMBL29926945 | 0.85 | PTPN1 (0.46) | MAOBPTPN1ALDH1A1KDM4EMAPT | |
| SCHEMBL28837163 | 0.85 | PTPN1 (0.46) | MAOBPTPN1ALDH1A1KDM4EMAPT | |
| SCHEMBL28837157 | 0.84 | GSK3B (0.49) | CA1CA2ALDH1A1KDM4EMAPT | |
| SCHEMBL29927513 | 0.84 | MAPT (0.52) | CA1CA2PTPN1MAPTCYP3A4 | |
| SCHEMBL28837150 | 0.84 | MAPT (0.52) | CA1CA2PTPN1MAPTCYP3A4 | |
| SCHEMBL29926908 | 0.83 | PTGS2 (0.46) | PTPN1MAPTTNKS | |
| SCHEMBL29406889 | 0.83 | CYP2C9 (0.55) | MAOBCA1CA2PTPN1ALDH1A1 | |
| SCHEMBL28837148 | 0.83 | PTGS2 (0.46) | PTPN1MAPTTNKS | |
| SCHEMBL28837145 | 0.82 | PTPN1 (0.44) | PTPN1MAPTCYP3A4MEN1KMT2A |
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-115043802-A | Synthesis method of trifluoroethyl benzofuran compound | 温州大学 | 2022-09-13 | — | — | CN | disclosed |