Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STS | P08842 | 2/20 | 0.56 |
| ▸ | HSD17B1 | P14061 | 6/20 | 0.54 |
| ▸ | LMNA | P02545 | 6/20 | 0.54 |
| ▸ | MAPT | P10636 | 6/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.54 |
| ▸ | ESR1 | P03372 | 5/20 | 0.54 |
| ▸ | PGR | P06401 | 3/20 | 0.54 |
| ▸ | AR | P10275 | 3/20 | 0.54 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.54 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.54 |
| ▸ | SHBG | P04278 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | SERPINA6 | P08185 | 1/20 | 0.54 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.54 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.54 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.54 |
| ▸ | SNCA | P37840 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL22236702 | 1.00 | STS (0.56) | STSHSD17B1LMNAMAPTCYP3A4 | |
| SCHEMBL22089405 | 1.00 | STS (0.56) | STSHSD17B1LMNAMAPTCYP3A4 | |
| SCHEMBL22524226 | 0.94 | HSD17B1 (0.53) | STSHSD17B1LMNAMAPTCYP3A4 | |
| SCHEMBL22236741 | 0.94 | HSD17B1 (0.53) | STSHSD17B1LMNAMAPTCYP3A4 | |
| SCHEMBL22089279 | 0.93 | STS (0.48) | STSHSD17B1LMNAMAPTCYP3A4 | |
| SCHEMBL22088747 | 0.93 | STS (0.48) | STSHSD17B1LMNAMAPTCYP3A4 | |
| SCHEMBL22088746 | 0.93 | STS (0.48) | STSHSD17B1LMNAMAPTCYP3A4 | |
| SCHEMBL22236698 | 0.93 | STS (0.48) | STSHSD17B1LMNAMAPTCYP3A4 | |
| SCHEMBL22236691 | 0.91 | STS (0.47) | STSHSD17B1LMNAMAPTCYP3A4 | |
| SCHEMBL22088765 | 0.91 | STS (0.47) | STSHSD17B1LMNAMAPTCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020115371-A1 | ESTRA-1,3,5(10)-TRIENE COMPOUNDS CONDENSED IN POSITION 16(17) WITH A PYRAZOLE RING AS INHIBITORS OF 17-HSD1 | FORENDO PHARMA LTD (FI) | 2020-06-11 | — | — | WO | disclosed |