Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 10/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 10/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 8/20 | 0.49 |
| ▸ | DPP4 | P27487 | 3/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | SPR | P35270 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3825564 | 1.00 | PGR (0.49) | PGRCYP2C9CYP2D6DPP4KCNH2 | |
| SCHEMBL3025009 | 0.86 | DPP4 (0.50) | PGRCYP2C9CYP2D6DPP4HDAC8 | |
| SCHEMBL13238912 | 0.82 | ALDH1A1 (0.53) | PGRCYP2C9CYP2D6DPP4HDAC8 | |
| SCHEMBL3024142 | 0.79 | PGR (0.51) | PGRCYP2C9CYP2D6DPP4KCNH2 | |
| SCHEMBL380969 | 0.77 | ALDH1A1 (0.61) | DPP4HDAC8HDAC6L3MBTL1 | |
| SCHEMBL3037282 | 0.76 | PGR (0.51) | PGRCYP2C9CYP2D6DPP4KCNH2 | |
| SCHEMBL3326284 | 0.76 | DPP4 (0.49) | PGRDPP4KCNH2HDAC8HDAC6 | |
| SCHEMBL3326291 | 0.76 | DPP4 (0.49) | PGRDPP4KCNH2HDAC8HDAC6 | |
| SCHEMBL3326316 | 0.76 | DPP4 (0.49) | PGRDPP4KCNH2HDAC8HDAC6 | |
| SCHEMBL12043205 | 0.75 | AR (0.44) | PGRCYP2C9CYP2D6DPP4KCNH2 |
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-2094269-A1 | PYRROLIDINANILINES | Smithkline Beecham Corporation (US) | 2009-09-02 | — | — | EP | disclosed |
| WO-2008077089-A1 | PYRROLIDINANILINES | SMITHKLINE BEECHAM CORPORATION (US) | 2008-06-26 | — | — | WO | disclosed |