Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 8/20 | 0.48 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.48 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | DRD4 | P21917 | 2/20 | 0.43 |
| ▸ | DRD3 | P35462 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | RXRB | P28702 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL26682906 | 0.89 | OPRD1 (0.41) | CCR5DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL26680525 | 0.88 | CHEK1 (0.48) | CCR5CHEK1DRD2DRD4DRD3 | |
| SCHEMBL26682745 | 0.88 | CHEK1 (0.46) | CCR5CHEK1DRD2DRD4DRD3 | |
| SCHEMBL26680397 | 0.88 | MEN1 (0.43) | CCR5CHEK1DRD2DRD4DRD3 | |
| SCHEMBL26682606 | 0.88 | TP53 (0.43) | CCR5DRD2DRD4DRD3MAPT | |
| SCHEMBL26682099 | 0.87 | RXRA (0.49) | CCR5DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL26682661 | 0.86 | MAPT (0.59) | CCR5ALDH1A1MAPTL3MBTL1HSD17B10 | |
| SCHEMBL26680403 | 0.86 | DRD2 (0.45) | CCR5CHEK1DRD2DRD4DRD3 | |
| SCHEMBL26682042 | 0.85 | CCR5 (0.40) | CCR5CHEK1DRD2DRD4DRD3 | |
| SCHEMBL26681027 | 0.83 | RET (0.39) | CCR5ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4279476-A1 | METHOD FOR ALKYLATING ACIDIC FUNCTIONAL GROUP | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2023-11-22 | — | — | EP | disclosed |