Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 19/20 | 0.72 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.71 |
| ▸ | HTR1A | P08908 | 1/20 | 0.52 |
| ▸ | DRD2 | P14416 | 1/20 | 0.52 |
| ▸ | DRD4 | P21917 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.52 |
| ▸ | HRH1 | P35367 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | HTR2B | P41595 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL6615050 | 0.99 | CCR5 (0.73) | CCR5CXCR4HTR1ADRD2DRD4 | |
| SCHEMBL6614553 | 0.99 | CCR5 (0.73) | CCR5CXCR4HTR1ADRD2DRD4 | |
| SCHEMBL6615821 | 0.98 | CCR5 (0.68) | CCR5CXCR4 | |
| SCHEMBL6614915 | 0.94 | CCR5 (0.63) | CCR5CXCR4 | |
| SCHEMBL6611813 | 0.91 | CCR5 (0.69) | CCR5CXCR4 | |
| SCHEMBL6614731 | 0.91 | CCR5 (0.58) | CCR5CXCR4HTR1ADRD2DRD4 | |
| SCHEMBL6610609 | 0.90 | CCR5 (0.59) | CCR5CXCR4HTR1ADRD2DRD4 | |
| SCHEMBL6644502 | 0.90 | CCR5 (0.57) | CCR5CXCR4HTR1ADRD2DRD4 | |
| SCHEMBL6617863 | 0.90 | CCR5 (0.59) | CCR5CXCR4HTR1ADRD2DRD4 | |
| SCHEMBL6611715 | 0.90 | CCR5 (0.58) | CCR5CXCR4HTR1ADRD2DRD4 |
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 |