Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 4/20 | 0.43 |
| ▸ | MTOR | P42345 | 2/20 | 0.43 |
| ▸ | PIK3C2B | O00750 | 1/20 | 0.43 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.43 |
| ▸ | PRKACA | P17612 | 1/20 | 0.43 |
| ▸ | PRKACG | P22612 | 1/20 | 0.43 |
| ▸ | PRKACB | P22694 | 1/20 | 0.43 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14104079 | 0.90 | CYP1A2 (0.36) | ABCG2CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL11990372 | 0.89 | AR (0.39) | ABCG2CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL14103888 | 0.89 | PIK3CA (0.37) | PIK3CAMTORABCG2CYP11B1CYP11B2 | |
| SCHEMBL4743431 | 0.89 | MAPK1 (0.40) | ABCG2CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL4738829 | 0.89 | NR1I3 (0.40) | ABCG2CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL4740912 | 0.89 | ABCG2 (0.35) | ABCG2CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL14103886 | 0.88 | ABCG2 (0.44) | ABCG2CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL14104180 | 0.87 | PIK3CA (0.47) | PIK3CAMTORPIK3C2BCCNE2PRKACA | |
| SCHEMBL4740295 | 0.85 | PTGS1 (0.40) | PIK3CAKDRABCG2MEN1CYP2C19 | |
| SCHEMBL4573992 | 0.84 | MAPK1 (0.44) | CDK2ABCG2CYP2C19MAPK1CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008092861-A1 | BICYCLIC DERIVATIVES AS EP4 AGONISTS | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-08-07 | — | — | WO | disclosed |