Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL78126 | 0.80 | ALDH1A1 (0.45) | ALDH1A1TDP1TGFBR1KDM4EHSD17B10 | |
| SCHEMBL7171041 | 0.80 | ALDH1A1 (0.45) | ALDH1A1TDP1TGFBR1KDM4EHSD17B10 | |
| SCHEMBL12315631 | 0.78 | TGFBR1 (0.35) | ALDH1A1TDP1TGFBR1KDM4ERXFP1 | |
| SCHEMBL2169758 | 0.77 | ALDH1A1 (0.35) | ALDH1A1TDP1TGFBR1KDM4ERXFP1 | |
| SCHEMBL12315627 | 0.75 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL13756084 | 0.75 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL12315624 | 0.75 | TGFBR1 (0.33) | ALDH1A1TGFBR1 | |
| SCHEMBL27808668 | 0.75 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL6852988 | 0.75 | ALDH1A1 (0.41) | ALDH1A1TDP1TGFBR1KDM4EHSD17B10 | |
| SCHEMBL11125396 | 0.75 | ALDH1A1 (0.41) | ALDH1A1TDP1TGFBR1KDM4EHSD17B10 |
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-2012142513-A1 | SUBSTITUTED BENZENE COMPOUNDS | Epizyme, Inc. (US) | 2012-10-18 | — | — | WO | disclosed |