Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.60 |
| ▸ | KLKB1 | P03952 | 16/20 | 0.58 |
| ▸ | KLK1 | P06870 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL4785257 | 0.87 | KLKB1 (0.55) | KLKB1KLK1KDM4EALDH1A1LMNA | |
| SCHEMBL1912400 | 0.84 | HSD17B10 (0.77) | HSD17B10KLKB1KLK1KDM4EALDH1A1 | |
| SCHEMBL27286142 | 0.82 | HSD17B10 (0.68) | HSD17B10KLKB1KLK1KDM4EALDH1A1 | |
| SCHEMBL3555395 | 0.80 | HDAC1 (0.60) | KLKB1KLK1ALDH1A1 | |
| SCHEMBL15652551 | 0.80 | ALDH1A1 (0.51) | HSD17B10KLKB1KLK1KDM4EALDH1A1 | |
| SCHEMBL19117032 | 0.79 | HSD17B10 (0.68) | HSD17B10KDM4EALDH1A1LMNA | |
| SCHEMBL553854 | 0.79 | HSD17B10 (0.60) | HSD17B10KLKB1KLK1KDM4EALDH1A1 | |
| SCHEMBL4785951 | 0.78 | HSD17B10 (0.59) | HSD17B10KLKB1KLK1KDM4EALDH1A1 | |
| SCHEMBL17663701 | 0.78 | LMNA (0.60) | KLKB1KLK1KDM4EALDH1A1LMNA | |
| SCHEMBL28818259 | 0.78 | KLKB1 (0.69) | HSD17B10KLKB1KLK1KDM4EALDH1A1 |
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-2008089436-A2 | CRYSTALLINE FORMS OF HISTONE DEACETYLASE INHIBITORS | TAKEDA SAN DIEGO, INC. (US) | 2008-07-24 | — | — | WO | disclosed |