Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.37 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | PNLIP | P16233 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.34 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.34 |
| ▸ | ABCC2 | Q92887 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 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 | |
|---|---|---|---|---|
| SCHEMBL8577523 | 0.88 | ABCG2 (0.42) | CYP19A1CYP3A4MAPTCYP2C9CYP2C19 | |
| SCHEMBL8574474 | 0.86 | PLK1 (0.37) | HCAR3HCAR2OPRM1OPRD1ALDH1A1 | |
| SCHEMBL8572826 | 0.86 | CYP19A1 (0.37) | CYP19A1CYP1A1CYP1A2CYP1B1MEN1 | |
| SCHEMBL8576046 | 0.80 | HCAR3 (0.32) | CYP3A4MAPTHCAR3HCAR2ALDH1A1 | |
| SCHEMBL8576216 | 0.79 | GAA (0.38) | MEN1MAPTKMT2AHCAR3HCAR2 | |
| SCHEMBL8577388 | 0.78 | GAA (0.39) | CYP1A2MEN1MAPTCYP2C19KMT2A | |
| SCHEMBL571667 | 0.75 | CYP19A1 (0.41) | CYP19A1CYP1A1CYP1A2CYP1B1MEN1 | |
| SCHEMBL8577569 | 0.75 | ABCG2 (0.42) | CYP19A1CYP3A4MAPTCYP2C9CYP2C19 | |
| SCHEMBL28636154 | 0.72 | MAPT (0.39) | CYP19A1CYP1A1CYP1A2CYP1B1MEN1 | |
| SCHEMBL8572760 | 0.72 | PLK1 (0.37) | MAOAHCAR3HCAR2ALDH1A1HSD11B1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998017662-A1 | PHENYL-SUBSTITUTED BICYCLIC HETEROCYCLYL DERIVATIVES AND THEIR USE | NOVARTIS AG (CH) | 1998-04-30 | — | — | WO | claimed |
| WO-1998017662-A1 | PHENYL-SUBSTITUTED BICYCLIC HETEROCYCLYL DERIVATIVES AND THEIR USE | NOVARTIS AG (CH) | 1998-04-30 | — | — | WO | disclosed |