Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAP2K1 | Q02750 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL212261 | 0.90 | MAP2K1 (0.42) | KDM4EMAP2K1L3MBTL1KMT2AALDH1A1 | |
| SCHEMBL14425112 | 0.83 | KDM4E (0.50) | KDM4EMAP2K1L3MBTL1KMT2AALDH1A1 | |
| SCHEMBL212292 | 0.83 | MAP2K1 (0.40) | KDM4EMAP2K1L3MBTL1KMT2AALDH1A1 | |
| SCHEMBL212291 | 0.83 | HDAC1 (0.48) | MAP2K1KMT2AALDH1A1RAB9AMEN1 | |
| SCHEMBL2759502 | 0.77 | KDM4E (0.47) | KDM4EMAP2K1L3MBTL1KMT2AALDH1A1 | |
| SCHEMBL2733478 | 0.74 | ATM (0.39) | KDM4EL3MBTL1KMT2AALDH1A1RAB9A | |
| SCHEMBL2733030 | 0.69 | MAP2K1 (0.44) | MAP2K1L3MBTL1KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL2759555 | 0.69 | MAP2K1 (0.46) | KDM4EMAP2K1L3MBTL1KMT2AALDH1A1 | |
| SCHEMBL2733655 | 0.69 | HDAC1 (0.48) | ALDH1A1RAB9AGAA | |
| SCHEMBL14424492 | 0.66 | MAP2K1 (0.43) | MAP2K1L3MBTL1KMT2AMEN1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-8088805-B2 | Inhibitors of histone deacetylase | METHYLGENE INC. (CA) | 2012-01-03 | — | — | US | disclosed |