Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.62 |
| ▸ | SHBG | P04278 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | SERPINA6 | P08185 | 2/20 | 0.58 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.58 |
| ▸ | THRB | P10828 | 1/20 | 0.58 |
| ▸ | PGR | P06401 | 4/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | ESR1 | P03372 | 1/20 | 0.53 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.53 |
| ▸ | AR | P10275 | 3/20 | 0.50 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3643471 | 1.00 | CYP19A1 (0.62) | CYP19A1SHBGALDH1A1SERPINA6SLC22A1 | |
| SCHEMBL1421923 | 0.83 | CYP19A1 (0.51) | CYP19A1SHBGALDH1A1SERPINA6SLC22A1 | |
| SCHEMBL16661465 | 0.83 | CYP19A1 (0.51) | CYP19A1SHBGALDH1A1SERPINA6SLC22A1 | |
| SCHEMBL9327894 | 0.83 | CYP19A1 (0.51) | CYP19A1SHBGALDH1A1SERPINA6SLC22A1 | |
| SCHEMBL2318050 | 0.83 | CYP19A1 (0.51) | CYP19A1SHBGALDH1A1SERPINA6SLC22A1 | |
| SCHEMBL5925231 | 0.83 | AR (0.61) | CYP19A1SHBGALDH1A1SERPINA6SLC22A1 | |
| SCHEMBL13460261 | 0.82 | CYP19A1 (0.55) | CYP19A1SHBGALDH1A1SERPINA6SLC22A1 | |
| SCHEMBL3643478 | 0.82 | CYP19A1 (0.55) | CYP19A1SHBGALDH1A1SERPINA6SLC22A1 | |
| SCHEMBL9547768 | 0.80 | SHBG (0.47) | CYP19A1SHBGALDH1A1SERPINA6SLC22A1 | |
| SCHEMBL13055680 | 0.78 | ALDH1A1 (0.65) | CYP19A1SHBGALDH1A1SERPINA6SLC22A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2170925-B1 | 17ß -CYANO-19-NOR-ANDROST-4-ENE DERIVATIVE, USE THEREOF AND MEDICAMENTS CONTAINING SAID DERIVATIVE | BAYER IP GMBH (DE) | 2012-10-24 | — | — | EP | disclosed |