Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.56 |
| ▸ | HSD17B2 | P37059 | 14/20 | 0.56 |
| ▸ | HSD17B1 | P14061 | 13/20 | 0.56 |
| ▸ | APP | P05067 | 1/20 | 0.51 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.48 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.48 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.48 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL23088 | 0.89 | HSD17B2 (0.70) | HDAC6HSD17B2HSD17B1 | |
| SCHEMBL23457 | 0.88 | HSD17B1 (0.70) | HDAC6HSD17B2HSD17B1 | |
| SCHEMBL18195278 | 0.84 | HSD17B2 (0.65) | HDAC6HSD17B2HSD17B1MAPK13MAPK12 | |
| SCHEMBL23125 | 0.82 | HSD17B2 (0.65) | HDAC6HSD17B2HSD17B1LMNA | |
| SCHEMBL23779 | 0.82 | HSD17B2 (0.67) | HDAC6HSD17B2HSD17B1 | |
| SCHEMBL23339 | 0.81 | HSD17B2 (0.66) | HDAC6HSD17B2HSD17B1MAPK13MAPK12 | |
| SCHEMBL12496068 | 0.81 | HSD17B2 (0.83) | HDAC6HSD17B2HSD17B1 | |
| SCHEMBL23360 | 0.80 | HSD17B1 (0.64) | HDAC6HSD17B2HSD17B1 | |
| SCHEMBL23735 | 0.80 | HSD17B2 (0.60) | HDAC6HSD17B2HSD17B1 | |
| SCHEMBL21873 | 0.79 | HSD17B2 (0.62) | HDAC6HSD17B2HSD17B1 |
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 3 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 | disclosed |
| WO-2012025638-A1 | SELECTIVE 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS | Universität des Saarlandes (DE) | 2012-03-01 | — | — | WO | disclosed |
| WO-2012025638-A1 | SELECTIVE 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS | Universität des Saarlandes (DE) | 2012-03-01 | — | — | WO | disclosed |