Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 19/20 | 0.46 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.43 |
| ▸ | CXCR4 | P61073 | 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 | |
|---|---|---|---|---|
| SCHEMBL6612313 | 0.92 | CCR5 (0.56) | CCR5CXCR3 | |
| SCHEMBL6612832 | 0.92 | CCR5 (0.45) | CCR5CXCR3CXCR4 | |
| SCHEMBL6613392 | 0.91 | CCR5 (0.48) | CCR5CXCR3CXCR4 | |
| SCHEMBL6614434 | 0.90 | CCR5 (0.53) | CCR5CXCR3CXCR4 | |
| SCHEMBL6612641 | 0.90 | CXCR3 (0.54) | CCR5CXCR3CXCR4 | |
| SCHEMBL6616832 | 0.90 | CCR5 (0.58) | CCR5CXCR3 | |
| SCHEMBL6613862 | 0.89 | CCR5 (0.56) | CCR5CXCR3CXCR4 | |
| SCHEMBL6615098 | 0.89 | CCR5 (0.57) | CCR5CXCR3CXCR4 | |
| SCHEMBL6615193 | 0.89 | CCR5 (0.57) | CCR5CXCR3CXCR4 | |
| SCHEMBL6615745 | 0.84 | CCR5 (0.51) | CCR5CXCR3CXCR4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1236726-B1 | TRIAZASPIRO 5.5]UNDECANE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | ONO PHARMACEUTICAL CO (JP) | 2004-12-01 | — | — | EP | disclosed |
| EP-1236726-A1 | TRIAZASPIRO 5.5]UNDECANE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | ONO PHARMACEUTICAL CO., LTD. (JP) | 2002-09-04 | — | — | EP | disclosed |