Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5AP | P20292 | 1/20 | 0.41 |
| ▸ | FEN1 | P39748 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 4/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 5/20 | 0.35 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.34 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.34 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.34 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.34 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.34 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.34 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.34 |
| ▸ | WDR5 | P61964 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.33 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL112035 | 0.83 | CNR2 (0.42) | ALOX5APFEN1CNR2AOC3WDR5 | |
| SCHEMBL113179 | 0.81 | CNR2 (0.40) | ALOX5APFEN1CNR2AOC3WDR5 | |
| SCHEMBL115679 | 0.78 | ALOX5AP (0.38) | ALOX5APFEN1CNR2AOC3PIK3CD | |
| SCHEMBL113998 | 0.77 | AOC3 (0.39) | ALOX5APFEN1CNR2AOC3WDR5 | |
| SCHEMBL3732875 | 0.76 | CXCR3 (0.48) | CNR2AOC3KCNH2 | |
| SCHEMBL113125 | 0.75 | CXCR3 (0.40) | ALOX5APFEN1CNR2AOC3KDM4E | |
| SCHEMBL114041 | 0.74 | CXCR3 (0.39) | FEN1AOC3KDM4EKCNH2 | |
| SCHEMBL114405 | 0.74 | CXCR3 (0.39) | AOC3KCNH2 | |
| SCHEMBL113873 | 0.74 | KDM4E (0.41) | WDR5SMN1; SMN2KDM4E | |
| SCHEMBL113141 | 0.74 | CXCR3 (0.38) | ALOX5APFEN1CNR2AOC3WDR5 |
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-2424840-A1 | CXCR3 RECEPTOR ANTAGONISTS | Boehringer Ingelheim International GmbH (DE) | 2012-03-07 | — | — | EP | disclosed |
| WO-2010126811-A1 | CXCR3 RECEPTOR ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-11-04 | — | — | WO | disclosed |