Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 3/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | GRIN2B | Q13224 | 15/20 | 0.44 |
| ▸ | GRM5 | P41594 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL164717 | 0.93 | GRIN2B (0.45) | CXCR3GRIN2BGRM5CYP2C9CYP2C19 | |
| SCHEMBL3724584 | 0.87 | GRIN2B (0.48) | GRIN2BGRM5 | |
| SCHEMBL3735698 | 0.85 | GRIN2B (0.49) | GRIN2B | |
| SCHEMBL167110 | 0.84 | GRIN2B (0.45) | CXCR3KCNH2GRIN2BGRM5 | |
| SCHEMBL160222 | 0.82 | GRIN2B (0.40) | CXCR3GRIN2BGRM5 | |
| SCHEMBL3735612 | 0.81 | GRIN2B (0.42) | CXCR3KCNH2GRIN2B | |
| SCHEMBL3735661 | 0.78 | CXCR3 (0.46) | CXCR3KCNH2GRIN2BGRM5 | |
| SCHEMBL114594 | 0.75 | CXCR3 (0.44) | CXCR3KCNH2GRIN2B | |
| SCHEMBL13076636 | 0.74 | SCN10A (0.40) | CXCR3GRIN2BGRM5 | |
| SCHEMBL3735551 | 0.72 | GRM5 (0.46) | CXCR3GRIN2BGRM5 |
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 |