Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 20/20 | 0.69 |
| ▸ | HSD17B2 | P37059 | 20/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL22898 | 0.81 | HSD17B1 (1.00) | HSD17B1HSD17B2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL31415 | 0.77 | HSD17B1 (0.65) | HSD17B1HSD17B2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL10353029 | 0.76 | HSD17B1 (0.79) | HSD17B1HSD17B2HSD17B14 | |
| SCHEMBL1180208 | 0.74 | HSD17B1 (1.00) | HSD17B1HSD17B2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL23296 | 0.73 | HSD17B1 (0.48) | HSD17B1HSD17B2 | |
| SCHEMBL29848168 | 0.72 | HSD17B1 (0.96) | HSD17B1HSD17B2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL12656410 | 0.72 | HSD17B1 (0.96) | HSD17B1HSD17B2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL30431 | 0.72 | HSD17B1 (1.00) | HSD17B1HSD17B2 | |
| SCHEMBL31061230 | 0.70 | HSD17B1 (1.00) | HSD17B1HSD17B2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL9390168 | 0.70 | HSD17B1 (0.51) | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2609089-A1 | SELECTIVE 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS | Universität des Saarlandes (DE) | 2013-07-03 | — | — | EP | claimed |
| WO-2012025638-A1 | SELECTIVE 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS | Universität des Saarlandes (DE) | 2012-03-01 | — | — | WO | claimed |
| EP-2609089-A1 | SELECTIVE 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS | Universität des Saarlandes (DE) | 2013-07-03 | — | — | EP | disclosed |
| WO-2012025638-A1 | SELECTIVE 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS | Universität des Saarlandes (DE) | 2012-03-01 | — | — | WO | disclosed |