Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 7/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | USP7 | Q93009 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1800769 | 1.00 | CXCR3 (0.41) | CXCR3CCR5L3MBTL1GAAUSP7 | |
| Hydrochloric Acid SCHEMBL1800156 | 0.99 | CCR5 (0.41) | CXCR3CCR5L3MBTL1GAAUSP7 | |
| SCHEMBL2938955 | 0.94 | CXCR3 (0.42) | CXCR3CCR5L3MBTL1GAA | |
| SCHEMBL2938951 | 0.94 | CXCR3 (0.42) | CXCR3CCR5L3MBTL1GAA | |
| SCHEMBL1800476 | 0.94 | CXCR3 (0.42) | CXCR3CCR5L3MBTL1GAA | |
| Hydrochloric Acid SCHEMBL1800981 | 0.94 | CXCR3 (0.41) | CXCR3CCR5L3MBTL1GAA | |
| SCHEMBL2940902 | 0.93 | CYP2D6 (0.41) | CXCR3CCR5CYP2D6TSHRHDAC6 | |
| SCHEMBL1801540 | 0.93 | CYP2D6 (0.41) | CXCR3CCR5CYP2D6TSHRHDAC6 | |
| SCHEMBL2940899 | 0.93 | CYP2D6 (0.41) | CXCR3CCR5CYP2D6TSHRHDAC6 | |
| Hydrochloric Acid SCHEMBL1800899 | 0.92 | CYP2D6 (0.41) | CXCR3CCR5CYP2D6TSHRHDAC6 |
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-1730147-B1 | SUBSTITUTED 1,4,8-TRIAZASPIRO[4,5]DECAN-2-ON COMPOUNDS FOR USE IN THE TREATMENT OF OBESITY | GRUENENTHAL GMBH (DE) | 2010-02-03 | — | — | EP | claimed |
| EP-1730147-B1 | SUBSTITUTED 1,4,8-TRIAZASPIRO[4,5]DECAN-2-ON COMPOUNDS FOR USE IN THE TREATMENT OF OBESITY | GRUENENTHAL GMBH (DE) | 2010-02-03 | — | — | EP | disclosed |