Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CRAT | P43155 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | PLA2G2C | Q5R387 | 1/20 | 0.30 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.30 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.30 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11296644 | 0.80 | — | — | |
| SCHEMBL11523628 | 0.77 | PLA2G2C (0.39) | KDM4EMAPTTHRBALOX15NFKB1 | |
| SCHEMBL24629598 | 0.75 | ALDH1A1 (0.35) | KDM4EMAPTTHRBALOX15NFKB1 | |
| SCHEMBL24126227 | 0.74 | PLA2G2C (0.34) | KDM4EMAPTTHRBALOX15NFKB1 | |
| SCHEMBL5818367 | 0.72 | PLA2G2C (0.46) | MAPTALDH1A1PLA2G2C | |
| SCHEMBL6559575 | 0.72 | PLA2G2C (0.42) | MAPTRECQLSMN1; SMN2ALDH1A1TSHR | |
| SCHEMBL13716617 | 0.70 | — | — | |
| SCHEMBL7796543 | 0.69 | CTRB1 (0.59) | CTRB1 | |
| SCHEMBL11685724 | 0.68 | CTSK (0.38) | KDM4EMAPTTHRBALOX15NFKB1 | |
| SCHEMBL366041 | 0.67 | — | — |
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-108473305-B | System and method to detect the source of a molecule, and computer readable medium | 北德克萨斯大学 | 2020-01-03 | — | — | CN | disclosed |