Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | HPGD | P15428 | 6/20 | 0.48 |
| ▸ | POLB | P06746 | 5/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | MLYCD | O95822 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | APEX1 | P27695 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4607677 | 0.82 | HPGD (0.62) | ALDH1A1HPGDPOLBL3MBTL1MAPT | |
| SCHEMBL4606734 | 0.73 | NPY1R (0.46) | ALDH1A1HPGDPOLBL3MBTL1MAPT | |
| SCHEMBL7415087 | 0.71 | MLYCD (0.64) | ALDH1A1HPGDPOLBL3MBTL1MAPT | |
| SCHEMBL4169539 | 0.70 | MAPT (0.41) | ALDH1A1HPGDPOLBL3MBTL1MAPT | |
| SCHEMBL28017807 | 0.69 | POLB (0.65) | ALDH1A1HPGDPOLBL3MBTL1MAPT | |
| SCHEMBL4156245 | 0.69 | CES1 (0.44) | ALDH1A1HPGDPOLBL3MBTL1MAPT | |
| SCHEMBL9420448 | 0.68 | POLB (0.63) | ALDH1A1HPGDPOLBL3MBTL1MAPT | |
| SCHEMBL12466814 | 0.67 | MLYCD (0.58) | ALDH1A1HPGDPOLBL3MBTL1MAPT | |
| SCHEMBL10320562 | 0.66 | CES1 (0.50) | ALDH1A1HPGDPOLBMAPTMLYCD | |
| SCHEMBL2115850 | 0.66 | HPGD (1.00) | ALDH1A1HPGDPOLBL3MBTL1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1945609-A2 | AMINO ACID DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) | 2008-07-23 | — | — | EP | disclosed |
| WO-2007029036-A2 | AMINO ACID DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2007-03-15 | — | — | WO | disclosed |