Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MBOAT4 | Q96T53 | 2/20 | 0.45 |
| ▸ | SHBG | P04278 | 2/20 | 0.38 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.38 |
| ▸ | PGR | P06401 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | AR | P10275 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | SERPINA6 | P08185 | 1/20 | 0.38 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.38 |
| ▸ | FGF2 | P09038 | 1/20 | 0.36 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.36 |
| ▸ | PRKCA | P17252 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL7082956 | 1.00 | MBOAT4 (0.45) | MBOAT4SHBGGPBAR1NR3C1PGR | |
| SCHEMBL7074964 | 0.91 | MBOAT4 (0.43) | MBOAT4SHBGGPBAR1NR3C1PGR | |
| SCHEMBL7074961 | 0.91 | MBOAT4 (0.43) | MBOAT4SHBGGPBAR1NR3C1PGR | |
| SCHEMBL7079593 | 0.88 | MBOAT4 (0.44) | MBOAT4SHBGGPBAR1NR3C1PGR | |
| SCHEMBL145680 | 0.82 | CYP19A1 (0.57) | MBOAT4SHBGGPBAR1NR3C1PGR | |
| SCHEMBL11332329 | 0.82 | CYP19A1 (0.57) | MBOAT4SHBGGPBAR1NR3C1PGR | |
| SCHEMBL4936801 | 0.82 | CYP19A1 (0.57) | MBOAT4SHBGGPBAR1NR3C1PGR | |
| SCHEMBL11324207 | 0.81 | MBOAT4 (0.46) | MBOAT4SHBGGPBAR1NR3C1PGR | |
| SCHEMBL7077619 | 0.81 | AR (0.42) | SHBGGPBAR1NR3C1PGRCYP3A4 | |
| SCHEMBL11324212 | 0.81 | MBOAT4 (0.46) | MBOAT4SHBGGPBAR1NR3C1PGR |
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-1322660-A2 | 17ALPHA-FLUOROALKYL STEROIDS, METHOD FOR PRODUCING THE SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID COMPOUNDS | Schering AG (DE) | 2003-07-02 | — | — | EP | disclosed |
| WO-2002026759-A2 | 17α FLUOROALKYL STEROIDS, METHOD FOR PRODUCING THE SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID COMPOUNDS | SCHERING AG (DE) | 2002-04-04 | — | — | WO | disclosed |