Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 7/20 | 0.41 |
| ▸ | SHBG | P04278 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | SERPINA6 | P08185 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | MBOAT4 | Q96T53 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8370954 | 0.89 | CYP19A1 (0.41) | CYP19A1SHBGALDH1A1SLC22A1SERPINA6 | |
| SCHEMBL9948623 | 0.83 | CYP19A1 (0.44) | CYP19A1SHBGALDH1A1SLC22A1SERPINA6 | |
| SCHEMBL3356889 | 0.82 | CYP19A1 (0.44) | CYP19A1SHBGALDH1A1SLC22A1SERPINA6 | |
| SCHEMBL4945163 | 0.82 | SHBG (0.48) | CYP19A1SHBGALDH1A1SLC22A1SERPINA6 | |
| SCHEMBL6301569 | 0.82 | CYP19A1 (0.44) | CYP19A1SHBGALDH1A1SLC22A1SERPINA6 | |
| SCHEMBL9947828 | 0.81 | CYP19A1 (0.42) | CYP19A1SHBGALDH1A1SLC22A1SERPINA6 | |
| SCHEMBL10449145 | 0.77 | CYP19A1 (0.39) | CYP19A1SHBGALDH1A1SLC22A1SERPINA6 | |
| SCHEMBL6244893 | 0.77 | SERPINA6 (0.41) | CYP19A1SHBGALDH1A1SLC22A1SERPINA6 | |
| SCHEMBL922877 | 0.77 | CYP19A1 (0.66) | CYP19A1SHBGALDH1A1SLC22A1SERPINA6 | |
| SCHEMBL11977689 | 0.77 | CYP19A1 (0.66) | CYP19A1SHBGALDH1A1SLC22A1SERPINA6 |
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 |
|---|---|---|---|---|---|---|---|
| US-8207150-B2 | 17β-cyano-19-nor-androst-4-ene derivative, its use and medicaments comprising the derivative | Bayer Pharma AG (DE) | 2012-06-26 | — | — | US | disclosed |