Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 4/20 | 0.70 |
| ▸ | STS | P08842 | 6/20 | 0.60 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.54 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.48 |
| ▸ | HSD17B1 | P14061 | 4/20 | 0.48 |
| ▸ | ESR1 | P03372 | 6/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | PGR | P06401 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | AR | P10275 | 3/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.45 |
| ▸ | HTR2B | P41595 | 3/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.45 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | SERPINA6 | P08185 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7864592 | 0.83 | SHBG (1.00) | SHBGSTSABCB11HSD17B1ESR1 | |
| SCHEMBL29643366 | 0.83 | SHBG (1.00) | SHBGSTSABCB11HSD17B1ESR1 | |
| SCHEMBL712443 | 0.83 | SHBG (1.00) | SHBGSTSABCB11HSD17B1ESR1 | |
| SCHEMBL172746 | 0.83 | SHBG (1.00) | SHBGSTSABCB11HSD17B1ESR1 | |
| SCHEMBL6695130 | 0.81 | SHBG (0.75) | SHBGSTSABCB11HSD17B1ESR1 | |
| SCHEMBL14048691 | 0.81 | SHBG (0.46) | SHBGSTSAKR1C3ABCB11HSD17B1 | |
| SCHEMBL6842205 | 0.80 | AKR1C3 (0.49) | SHBGSTSAKR1C3ABCB11HSD17B1 | |
| SCHEMBL13951936 | 0.80 | STS (0.71) | SHBGSTSHSD17B1ESR1ESR2 | |
| SCHEMBL15973298 | 0.80 | AKR1C3 (0.53) | SHBGSTSAKR1C3ABCB11HSD17B1 | |
| SCHEMBL15973296 | 0.80 | STS (0.71) | SHBGSTSHSD17B1ESR1ESR2 |
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-2147014-B1 | 17ALPHA-SUBSTITUTED STEROIDS AS SYSTEMIC ANTIANDROGENS AND SELECTIVE ANDROGEN RECEPTOR MODULATORS | ENDORECH INC (CA) | 2016-02-17 | — | — | EP | disclosed |