Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 18/20 | 0.66 |
| ▸ | HSD17B2 | P37059 | 18/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.64 |
| ▸ | HPGD | P15428 | 1/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23457 | 0.87 | HSD17B1 (0.70) | HSD17B1HSD17B2 | |
| SCHEMBL21940 | 0.81 | HSD17B1 (0.70) | HSD17B1HSD17B2 | |
| SCHEMBL30683 | 0.80 | HSD17B1 (1.00) | HSD17B1HSD17B2 | |
| SCHEMBL22914 | 0.79 | HSD17B1 (0.78) | HSD17B1HSD17B2 | |
| SCHEMBL22550 | 0.76 | HSD17B1 (0.88) | HSD17B1HSD17B2 | |
| SCHEMBL24822 | 0.75 | HDAC6 (0.56) | HSD17B1HSD17B2TDP1 | |
| SCHEMBL12474097 | 0.74 | HSD17B1 (0.64) | HSD17B1HSD17B2 | |
| SCHEMBL21944 | 0.74 | HSD17B1 (1.00) | HSD17B1HSD17B2 | |
| SCHEMBL31108 | 0.74 | HSD17B1 (0.50) | HSD17B1HSD17B2 | |
| SCHEMBL18195299 | 0.73 | HSD17B1 (1.00) | HSD17B1HSD17B2 |
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-2012025638-A1 | SELECTIVE 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS | Universität des Saarlandes (DE) | 2012-03-01 | — | — | WO | disclosed |