Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 15/20 | 0.39 |
| ▸ | NPY2R | P49146 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3916428 | 0.93 | KDM4E (0.42) | NPY2RALDH1A1 | |
| SCHEMBL3917086 | 0.83 | CCR5 (0.36) | CCR5ALDH1A1CXCR4 | |
| SCHEMBL3916498 | 0.77 | GAA (0.44) | ALDH1A1 | |
| SCHEMBL3926266 | 0.76 | MAPT (0.47) | ALDH1A1 | |
| SCHEMBL3918951 | 0.76 | LMNA (0.44) | ALDH1A1 | |
| SCHEMBL3927025 | 0.75 | CYP3A4 (0.44) | CCR5ALDH1A1 | |
| SCHEMBL3923626 | 0.73 | ALDH1A1 (0.46) | ALDH1A1 | |
| Benzamide SCHEMBL3916106 | 0.73 | GAA (0.39) | CCR5ALDH1A1 | |
| SCHEMBL3927597 | 0.73 | ALDH1A1 (0.48) | ALDH1A1 | |
| SCHEMBL1799198 | 0.72 | LMNA (0.39) | — |
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-7560468-B2 | Substituted 1,4,8-triazaspiro[4,5]decan-2-one compounds | GRUENENTHAL GMBH (DE) | 2009-07-14 | — | — | US | disclosed |