Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 20/20 | 0.69 |
| ▸ | CYP2D6 | P10635 | 15/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 15/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL14162418 | 0.88 | PGR (0.69) | PGRCYP2D6CYP2C9KCNH2 | |
| SCHEMBL3822220 | 0.86 | PGR (0.71) | PGRCYP2D6CYP2C9KCNH2 | |
| SCHEMBL14162365 | 0.85 | PGR (0.71) | PGRCYP2D6CYP2C9KCNH2 | |
| SCHEMBL3819111 | 0.85 | PGR (0.71) | PGRCYP2D6CYP2C9KCNH2 | |
| SCHEMBL3819105 | 0.85 | PGR (0.71) | PGRCYP2D6CYP2C9KCNH2 | |
| SCHEMBL14162419 | 0.85 | PGR (0.69) | PGRCYP2D6CYP2C9KCNH2 | |
| SCHEMBL14162407 | 0.84 | PGR (0.69) | PGRCYP2D6CYP2C9KCNH2 | |
| SCHEMBL14162540 | 0.84 | PGR (0.75) | PGRCYP2D6CYP2C9KCNH2 | |
| SCHEMBL14162408 | 0.83 | PGR (0.68) | PGRCYP2D6CYP2C9KCNH2 | |
| SCHEMBL3821463 | 0.82 | PGR (0.66) | PGRCYP2D6CYP2C9KCNH2 |
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-2008077089-A1 | PYRROLIDINANILINES | SMITHKLINE BEECHAM CORPORATION (US) | 2008-06-26 | — | — | WO | disclosed |