Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8038167 | 1.00 | SHBG (0.40) | SHBGMAPK1SMN1; SMN2SRD5A1KDM1A | |
| SCHEMBL8048190 | 1.00 | SHBG (0.40) | SHBGMAPK1SMN1; SMN2SRD5A1KDM1A | |
| SCHEMBL8052596 | 0.78 | SHBG (0.36) | SHBGSRD5A1KDM1A | |
| SCHEMBL8052597 | 0.78 | SHBG (0.36) | SHBGSRD5A1KDM1A | |
| SCHEMBL8038117 | 0.77 | ESR1 (0.50) | SHBGMAPK1SMN1; SMN2 | |
| SCHEMBL8050411 | 0.77 | ESR1 (0.50) | SHBGSRD5A1 | |
| SCHEMBL7213772 | 0.71 | SHBG (0.44) | SHBGCHRM2CHRM1CHRM3 | |
| SCHEMBL7516092 | 0.70 | CHRM2 (0.34) | MAPK1SMN1; SMN2SRD5A1KDM1ACHRM2 | |
| SCHEMBL7508416 | 0.69 | ESR1 (0.34) | MAPK1SMN1; SMN2SRD5A1CHRM2CHRM4 | |
| SCHEMBL1427141 | 0.68 | MAPK1 (0.50) | MAPK1SMN1; SMN2KDM1ACHRM2CHRM4 |
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-0882735-B1 | 9 Alpha-hydroxy-8 alpha-estra-1,3,5(10)-trienes and a process for their preparation | JENAPHARM GMBH (DE) | 2000-04-19 | — | — | EP | disclosed |
| EP-0882735-A1 | 9 Alpha-hydroxy-8 alpha-estra-1,3,5(10)-trienes and a process for their preparation | Jenapharm GmbH & Co. KG (DE) | 1998-12-09 | — | — | EP | disclosed |