Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 6/20 | 0.41 |
| ▸ | PGR | P06401 | 5/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.33 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.30 |
| ▸ | SHBG | P04278 | 1/20 | 0.30 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6244949 | 0.82 | AR (0.49) | ARPGRNR3C2CYP19A1MBOAT4 | |
| SCHEMBL7701342 | 0.78 | AR (0.39) | ARPGRNR3C2CYP19A1MBOAT4 | |
| SCHEMBL11795958 | 0.74 | AR (0.64) | ARPGRNR3C2CYP19A1SHBG | |
| SCHEMBL6387112 | 0.73 | AR (0.44) | ARPGRNR3C2CYP19A1MBOAT4 | |
| SCHEMBL8376991 | 0.71 | AR (0.35) | ARPGRNR3C2 | |
| SCHEMBL6244946 | 0.70 | AR (0.47) | ARPGRNR3C2CYP19A1MBOAT4 | |
| SCHEMBL9947828 | 0.69 | CYP19A1 (0.42) | PGRCYP19A1SHBG | |
| SCHEMBL11795639 | 0.69 | AR (0.40) | ARPGRNR3C2CYP19A1MBOAT4 | |
| SCHEMBL5152177 | 0.68 | AR (0.43) | ARPGRNR3C2CYP19A1MBOAT4 | |
| SCHEMBL7702632 | 0.67 | CYP19A1 (0.36) | ARPGRNR3C2CYP19A1 |
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-1163259-A1 | 14.BETA.,17-ALPHA-HYDROXYMETHYLANDROSTANE DERIVATIVES AS ANDROGENS | Akzo Nobel N.V. (NL) | 2001-12-19 | — | — | EP | disclosed |
| WO-2000053619-A1 | 14.BETA., 17-ALPHA-HYDROXYMETHYLANDROSTANE DERIVATIVES AS ANDROGENS | AKZO NOBEL N.V. (NL) | 2000-09-14 | — | — | WO | disclosed |