Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | PLAU | P00749 | 2/20 | 0.41 |
| ▸ | METAP2 | P50579 | 2/20 | 0.41 |
| ▸ | METAP1 | P53582 | 2/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3412375 | 0.82 | HDAC1 (0.50) | PTPN1SMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL1472059 | 0.79 | SMN1; SMN2 (0.52) | PTPN1SMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL11952407 | 0.78 | SMN1; SMN2 (0.51) | PTPN1SMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL11201642 | 0.77 | PTPN1 (0.56) | PTPN1SMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL3378718 | 0.76 | HDAC1 (0.50) | PTPN1SMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL14398426 | 0.74 | ALDH1A1 (0.57) | PTPN1SMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL3381011 | 0.73 | HDAC1 (0.71) | HDAC1HDAC8HDAC3HDAC4HDAC7 | |
| SCHEMBL7183372 | 0.73 | SMN1; SMN2 (0.46) | PTPN1SMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL9609685 | 0.71 | ALDH1A1 (0.46) | PTPN1SMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL3383140 | 0.70 | HDAC1 (0.76) | HDAC1HDAC8HDAC3HDAC4HDAC7 |
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-1280764-A2 | INHIBITORS OF HISTONE DEACETYLASE | Methylgene, Inc. (CA) | 2003-02-05 | — | — | EP | disclosed |
| WO-2001070675-A2 | INHIBITORS OF HISTONE DEACETYLASE | METHYLGENE, INC. (CA) | 2001-09-27 | — | — | WO | disclosed |