Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 4/20 | 0.72 |
| ▸ | THRB | P10828 | 2/20 | 0.66 |
| ▸ | MAPT | P10636 | 8/20 | 0.65 |
| ▸ | TLR2 | O60603 | 1/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.64 |
| ▸ | TNF | P01375 | 2/20 | 0.63 |
| ▸ | NOD1 | Q9Y239 | 2/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.63 |
| ▸ | LMNA | P02545 | 2/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL28663924 | 0.92 | ALDH1A1 (0.68) | TP53THRBMAPTTLR2KDM4E | |
| SCHEMBL28648841 | 0.89 | THRB (0.82) | TP53THRBMAPTKDM4EHSD17B10 | |
| SCHEMBL3913991 | 0.86 | MAPT (0.66) | TP53MAPTTLR2KDM4EHSD17B10 | |
| SCHEMBL2182372 | 0.84 | TP53 (0.80) | TP53THRBMAPTKDM4ETNF | |
| SCHEMBL3916162 | 0.84 | MAPT (0.80) | TP53MAPTTLR2KDM4EHSD17B10 | |
| SCHEMBL8290510 | 0.84 | MAPT (0.77) | TP53MAPTTLR2KDM4EHSD17B10 | |
| SCHEMBL5807115 | 0.83 | MAPT (0.71) | TP53THRBMAPTTLR2KDM4E | |
| SCHEMBL21333081 | 0.82 | THRB (0.59) | TP53THRBMAPTKDM4EHSD17B10 | |
| SCHEMBL12470159 | 0.82 | MAPT (0.76) | TP53MAPTTLR2KDM4EHSD17B10 | |
| SCHEMBL3914272 | 0.82 | MAPT (0.58) | TP53THRBMAPTKDM4EHSD17B10 |
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-113501807-A | Tetrahydrobenzothiophene compound, and preparation method and application of pharmaceutical composition | 重庆科技学院 | 2021-10-15 | — | — | CN | disclosed |