Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1432925 | 0.76 | — | — | |
| SCHEMBL3178600 | 0.75 | ALDH1A1 (0.36) | ALDH1A1TSHRL3MBTL1 | |
| SCHEMBL2489254 | 0.71 | FDPS (0.35) | ALDH1A1TSHRL3MBTL1 | |
| SCHEMBL15647631 | 0.70 | L3MBTL1 (0.32) | ALDH1A1TSHRL3MBTL1 | |
| SCHEMBL843624 | 0.66 | MAPT (0.32) | L3MBTL1 | |
| SCHEMBL7445196 | 0.66 | LMNA (0.38) | L3MBTL1 | |
| SCHEMBL15438530 | 0.66 | — | — | |
| SCHEMBL8052781 | 0.66 | LMNA (0.45) | L3MBTL1 | |
| SCHEMBL2767861 | 0.66 | DGAT1 (0.42) | — | |
| SCHEMBL5665801 | 0.65 | L3MBTL1 (0.32) | ALDH1A1L3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009117831-A9 | HYBRID MOLECULES HAVING MIXED VITAMIN D RECEPTOR AGONISM AND HISTONE DEACETYLASE INHIBITORY PROPERTIES | THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) | 2009-12-30 | — | — | WO | disclosed |
| WO-2009117831-A1 | HYBRID MOLECULES HAVING MIXED VITAMIN D RECEPTOR AGONISM AND HISTONE DEACETYLASE INHIBITORY PROPERTIES | THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) | 2009-10-01 | — | — | WO | disclosed |