Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 1/20 | 0.76 |
| ▸ | CCR5 | P51681 | 19/20 | 0.59 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL6615106 | 0.91 | CXCR3 (0.63) | CXCR3CCR5CXCR4 | |
| SCHEMBL6615626 | 0.91 | CXCR3 (0.69) | CXCR3CCR5 | |
| SCHEMBL6612247 | 0.90 | CXCR3 (0.92) | CXCR3CCR5 | |
| SCHEMBL6611426 | 0.90 | CXCR3 (0.71) | CXCR3CCR5CXCR4 | |
| SCHEMBL6613544 | 0.89 | CXCR3 (0.76) | CXCR3CCR5CXCR4 | |
| SCHEMBL6612455 | 0.87 | CCR5 (0.75) | CXCR3CCR5CXCR4 | |
| SCHEMBL2086327 | 0.87 | CXCR3 (0.74) | CXCR3CCR5CXCR4 | |
| SCHEMBL6615405 | 0.87 | CXCR3 (0.59) | CXCR3CCR5 | |
| SCHEMBL2084666 | 0.86 | CXCR3 (1.00) | CXCR3CCR5 | |
| SCHEMBL6615594 | 0.86 | CCR5 (0.79) | CXCR3CCR5CXCR4 |
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 |