Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 2/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.43 |
| ▸ | RELA | Q04206 | 2/20 | 0.43 |
| ▸ | AQP1 | P29972 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.36 |
| ▸ | PRKAB2 | O43741 | 2/20 | 0.35 |
| ▸ | PRKAG1 | P54619 | 2/20 | 0.35 |
| ▸ | PRKAA2 | P54646 | 2/20 | 0.35 |
| ▸ | PRKAA1 | Q13131 | 2/20 | 0.35 |
| ▸ | PRKAG3 | Q9UGI9 | 2/20 | 0.35 |
| ▸ | PRKAG2 | Q9UGJ0 | 2/20 | 0.35 |
| ▸ | PRKAB1 | Q9Y478 | 2/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.35 |
| ▸ | SENP1 | Q9P0U3 | 1/20 | 0.35 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4596919 | 0.85 | AQP1 (0.58) | AQP1EZH2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4230182 | 0.83 | AQP1 (0.42) | AQP1EZH2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL5140093 | 0.82 | AQP1 (0.58) | NFKB1NFKB2RELAAQP1NPC1 | |
| SCHEMBL4226043 | 0.81 | AQP1 (0.56) | AQP1EZH2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL5795152 | 0.81 | AQP1 (0.56) | AQP1EZH2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4596728 | 0.81 | SIRT2 (0.52) | AQP1PRKAB2PRKAG1PRKAA2PRKAA1 | |
| SCHEMBL4964691 | 0.80 | AQP1 (0.43) | AQP1EZH2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4964699 | 0.80 | AQP1 (0.43) | AQP1EZH2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4968974 | 0.76 | AQP1 (0.54) | NFKB1NFKB2RELAAQP1NPC1 | |
| SCHEMBL4968887 | 0.76 | AQP1 (0.41) | AQP1EZH2PRKAB2PRKAG1PRKAA2 |
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-1871354-A1 | TREATMENT OF PAIN | Wyeth (US) | 2008-01-02 | — | — | EP | claimed |
| WO-2006116171-A1 | TREATMENT OF PAIN | WYETH (US) | 2006-11-02 | — | — | WO | claimed |