Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 9/20 | 0.70 |
| ▸ | NR3C1 | P04150 | 6/20 | 0.70 |
| ▸ | PGR | P06401 | 5/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.70 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.70 |
| ▸ | HTR2B | P41595 | 1/20 | 0.70 |
| ▸ | LMNA | P02545 | 8/20 | 0.65 |
| ▸ | SERPINA6 | P08185 | 7/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.65 |
| ▸ | BLM | P54132 | 4/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.65 |
| ▸ | MEN1 | O00255 | 2/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.65 |
| ▸ | MAPT | P10636 | 2/20 | 0.65 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.65 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.65 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.65 |
| ▸ | TSHR | P16473 | 6/20 | 0.64 |
| ▸ | AR | P10275 | 4/20 | 0.64 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL148415 | 0.86 | SHBG (0.69) | SHBGNR3C1PGRALDH1A1ADRA1A | |
| SCHEMBL10867342 | 0.86 | SHBG (0.69) | SHBGNR3C1PGRALDH1A1ADRA1A | |
| SCHEMBL10867348 | 0.86 | SHBG (0.69) | SHBGNR3C1PGRALDH1A1ADRA1A | |
| SCHEMBL10868441 | 0.85 | SHBG (0.70) | SHBGNR3C1PGRALDH1A1ADRA1A | |
| SCHEMBL9624055 | 0.85 | SHBG (0.64) | SHBGNR3C1PGRALDH1A1ADRA1A | |
| SCHEMBL9624053 | 0.85 | SHBG (0.64) | SHBGNR3C1PGRALDH1A1ADRA1A | |
| SCHEMBL10892430 | 0.85 | SHBG (0.70) | SHBGNR3C1PGRALDH1A1ADRA1A | |
| Methyltestosterone SCHEMBL13768123 | 0.83 | SHBG (1.00) | SHBGNR3C1PGRALDH1A1ADRA1A | |
| SCHEMBL5023909 | 0.83 | SHBG (0.81) | SHBGNR3C1PGRALDH1A1ADRA1A | |
| SCHEMBL1899598 | 0.83 | SHBG (0.81) | SHBGNR3C1PGRALDH1A1ADRA1A |
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-5352809-A | 9-alpha-hydroxy steroids, process for their preparation, process for the preparation of the corresponding 9(11)-dehydro derivatives and pharmaceutical preparations containing such steroids | GIST-BROCADES N.V. (NL) | 1994-10-04 | — | — | US | disclosed |