Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CREBBP | Q92793 | 2/20 | 0.37 |
| ▸ | EP300 | Q09472 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.37 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.32 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.32 |
| ▸ | SELE | P16581 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7141267 | 0.89 | HDAC3 (0.37) | CREBBPEP300HDAC1HDAC2HDAC3 | |
| SCHEMBL7700574 | 0.86 | ALDH1A1 (0.38) | CREBBPEP300NPC1RAB9AALDH1A1 | |
| SCHEMBL7698739 | 0.80 | CREBBP (0.37) | CREBBPEP300HDAC1HDAC2HDAC3 | |
| SCHEMBL7704396 | 0.79 | CREBBP (0.34) | CREBBPEP300CD274MEN1KMT2A | |
| SCHEMBL7139514 | 0.76 | CHRM3 (0.35) | CREBBPEP300NPC1RAB9AALDH1A1 | |
| SCHEMBL7141349 | 0.76 | HDAC1 (0.45) | HDAC1HDAC2HDAC3CHRM3 | |
| SCHEMBL9193572 | 0.73 | CREBBP (0.43) | CREBBPEP300NPC1RAB9AALDH1A1 | |
| SCHEMBL7703580 | 0.72 | HCAR3 (0.38) | CREBBPEP300HDAC1HDAC2HDAC3 | |
| SCHEMBL5558536 | 0.72 | CFTR (0.40) | CREBBPEP300HDAC1HDAC2HDAC3 | |
| SCHEMBL9198598 | 0.71 | CREBBP (0.39) | CREBBPEP300ALDH1A1MEN1KMT2A |
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-1224174-A2 | BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2002-07-24 | — | — | EP | disclosed |
| WO-2001029011-A2 | BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2001-04-26 | — | — | WO | disclosed |