Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | PTPRA | P18433 | 1/20 | 0.36 |
| ▸ | CASR | P41180 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6165090 | 0.89 | HDAC6 (0.41) | MAPTDRD2DRD3HDAC3HDAC4 | |
| SCHEMBL6608281 | 0.88 | POLB (0.41) | MAPTRAB9APTPN1PTPRACASR | |
| SCHEMBL7456547 | 0.82 | KDM4E (0.42) | MAPTRAB9AALDH1A1KMT2AHDAC2 | |
| SCHEMBL6607963 | 0.82 | KMT2A (0.39) | MAPTRAB9ACASRALDH1A1DRD2 | |
| SCHEMBL6167470 | 0.80 | HDAC6 (0.42) | MAPTDRD2DRD3HDAC3HDAC4 | |
| SCHEMBL6606829 | 0.80 | TP53 (0.41) | MAPTRAB9AALDH1A1DRD2DRD3 | |
| SCHEMBL6163164 | 0.79 | HDAC6 (0.40) | MAPTRAB9AALDH1A1DRD2DRD3 | |
| SCHEMBL6613645 | 0.78 | MAPT (0.44) | MAPTHDAC3HDAC1HDAC2HDAC10 | |
| SCHEMBL6166114 | 0.78 | HDAC6 (0.41) | MAPTDRD2DRD3MAPK1KMT2A | |
| SCHEMBL6164325 | 0.77 | HDAC6 (0.40) | MAPTRAB9ADRD2DRD3KMT2A |
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-1379511-A1 | DIHYDRO-BENZO (b) (1, 4) DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS II | F. HOFFMANN-LA ROCHE AG (CH) | 2004-01-14 | — | — | EP | disclosed |
| WO-2002083652-A1 | DIHYDRO-BENZO [b] [1, 4] DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS II | F. HOFFMANN-LA ROCHE AG (CH) | 2002-10-24 | — | — | WO | disclosed |