Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 3/20 | 0.52 |
| ▸ | DRD2 | P14416 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.45 |
| ▸ | TACR2 | P21452 | 1/20 | 0.45 |
| ▸ | CCR5 | P51681 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5860221 | 0.93 | SLC6A4 (0.53) | SLC6A4DRD2ALDH1A1SLC6A2SLC6A3 | |
| SCHEMBL5858680 | 0.88 | DRD2 (0.52) | SLC6A4DRD2TACR2CCR5CYP2D6 | |
| SCHEMBL5858744 | 0.87 | DRD2 (0.68) | SLC6A4DRD2ALDH1A1TACR2CCR5 | |
| SCHEMBL5858700 | 0.85 | TACR2 (0.52) | SLC6A4DRD2TACR2CCR5CYP2D6 | |
| SCHEMBL5857960 | 0.83 | DRD2 (0.54) | SLC6A4DRD2TACR2CCR5CYP2D6 | |
| SCHEMBL5858702 | 0.82 | DRD2 (0.53) | SLC6A4DRD2TACR2CCR5CYP2D6 | |
| SCHEMBL5857996 | 0.82 | SLC6A4 (0.50) | SLC6A4DRD2SLC6A2SLC6A3TACR2 | |
| SCHEMBL5860217 | 0.80 | DRD2 (0.50) | SLC6A4DRD2TACR2CCR5CYP2D6 | |
| SCHEMBL5857199 | 0.79 | DRD2 (0.49) | SLC6A4DRD2TACR2CCR5CYP2D6 | |
| SCHEMBL5860215 | 0.78 | TACR2 (0.45) | SLC6A4DRD2TACR2CCR5CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-6989393-B2 | Ccr5 modulators benzimidazoles or benzotriazoles | ASTRAZENECA AB (SE) | 2006-01-24 | — | — | US | disclosed |