Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 5/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | HTR7 | P34969 | 2/20 | 0.35 |
| ▸ | HTR6 | P50406 | 2/20 | 0.35 |
| ▸ | WDR5 | P61964 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15911221 | 0.91 | CXCR3 (0.37) | CXCR3WDR5 | |
| SCHEMBL15911228 | 0.89 | CXCR3 (0.40) | CXCR3KCNH2WDR5ALDH1A1 | |
| SCHEMBL163847 | 0.85 | CXCR3 (0.50) | CXCR3KCNH2 | |
| SCHEMBL3730941 | 0.80 | CXCR3 (0.66) | CXCR3KCNH2GAAALDH1A1TSHR | |
| SCHEMBL15911460 | 0.79 | CXCR3 (0.41) | CXCR3KCNH2WDR5 | |
| SCHEMBL166781 | 0.76 | CXCR3 (0.52) | CXCR3KCNH2 | |
| SCHEMBL15911340 | 0.76 | CXCR3 (0.51) | CXCR3KCNH2GAADRD2ALDH1A1 | |
| SCHEMBL165663 | 0.75 | CXCR3 (0.53) | CXCR3KCNH2 | |
| SCHEMBL111968 | 0.74 | CXCR3 (0.37) | CXCR3KCNH2ALDH1A1 | |
| SCHEMBL165135 | 0.74 | CXCR3 (0.55) | CXCR3KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2424840-B1 | CXCR3 RECEPTOR ANTAGONISTS | BOEHRINGER INGELHEIM INT (DE) | 2014-08-06 | — | — | EP | disclosed |