Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 6/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | DRD3 | P35462 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | NPY2R | P49146 | 1/20 | 0.36 |
| ▸ | CPT1A | P50416 | 1/20 | 0.36 |
| ▸ | KCNQ2 | O43526 | 3/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6167245 | 0.90 | HDAC6 (0.40) | KMT2AMAPTMEN1ALDH1A1HPGD | |
| SCHEMBL6608215 | 0.87 | POLB (0.39) | MAPTCASRALDH1A1DRD2DRD3 | |
| SCHEMBL6625643 | 0.82 | MAPT (0.38) | KMT2AMAPTCASRALDH1A1DRD2 | |
| SCHEMBL6165043 | 0.82 | HDAC6 (0.41) | KMT2AMAPTMEN1TSHRDRD2 | |
| SCHEMBL7456547 | 0.79 | KDM4E (0.42) | KMT2AMAPTMEN1ALDH1A1RAB9A | |
| SCHEMBL6165150 | 0.79 | HDAC6 (0.39) | MAPTALDH1A1DRD2DRD3RAB9A | |
| SCHEMBL6167097 | 0.79 | HDAC6 (0.38) | KMT2AMAPTMEN1ALDH1A1TSHR | |
| SCHEMBL6164087 | 0.78 | HDAC6 (0.38) | KMT2AMAPTMEN1ALDH1A1HPGD | |
| SCHEMBL6433475 | 0.75 | HDAC6 (0.38) | MAPTALDH1A1DRD2DRD3RAB9A | |
| SCHEMBL6433297 | 0.75 | SCN9A (0.39) | KMT2AMEN1CASRALDH1A1HPGD |
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 |