Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 2/20 | 0.64 |
| ▸ | STS | P08842 | 3/20 | 0.52 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 4/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | SERPINA6 | P08185 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9194502 | 0.85 | SHBG (0.60) | SHBGSTSHSD17B1CYP19A1HTR2B | |
| SCHEMBL2712861 | 0.82 | SHBG (0.55) | SHBGSTSHTR1A | |
| SCHEMBL8571107 | 0.80 | SHBG (0.60) | SHBGSTSHSD17B1CYP19A1ESR1 | |
| SCHEMBL12474903 | 0.79 | SHBG (0.51) | SHBGSTSHSD17B1HTR1ACYP19A1 | |
| SCHEMBL30887214 | 0.79 | SHBG (0.70) | SHBGSTSHSD17B1CYP19A1HTR2B | |
| SCHEMBL13725675 | 0.79 | SHBG (0.70) | SHBGSTSHSD17B1CYP19A1HTR2B | |
| SCHEMBL29446097 | 0.79 | SHBG (0.70) | SHBGSTSHSD17B1CYP19A1HTR2B | |
| SCHEMBL975788 | 0.79 | SHBG (0.70) | SHBGSTSHSD17B1CYP19A1HTR2B | |
| SCHEMBL11096655 | 0.79 | SHBG (0.70) | SHBGSTSHSD17B1CYP19A1HTR2B | |
| SCHEMBL23645783 | 0.79 | SHBG (0.53) | SHBGSTSCYP19A1ESR1LMNA |
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-0986573-B1 | NON-ESTROGENIC ESTRADIOL DERIVATIVES WITH AN ANTIOXIDANT EFFECT | JENAPHARM GMBH (DE) | 2002-10-09 | — | — | EP | disclosed |
| EP-0138504-B1 | STEROID DERIVATIVES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-07-20 | — | — | EP | disclosed |