Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7028930 | 0.81 | HDAC7 (0.38) | HDAC7HDAC8HDAC6HDAC9HDAC5 | |
| SCHEMBL7947234 | 0.80 | — | — | |
| SCHEMBL7032509 | 0.79 | HDAC7 (0.37) | HDAC7HDAC8HDAC6HDAC9HDAC5 | |
| SCHEMBL11514498 | 0.79 | TP53 (0.38) | HDAC7HDAC8HDAC6HDAC9HDAC5 | |
| SCHEMBL30107911 | 0.77 | TP53 (0.36) | HDAC7HDAC8HDAC6HDAC9HDAC5 | |
| SCHEMBL28890999 | 0.76 | ADH1B (0.38) | HDAC7HDAC8HDAC6HDAC9HDAC5 | |
| SCHEMBL38650713 | 0.74 | HDAC7 (0.38) | HDAC7HDAC8HDAC6HDAC9HDAC5 | |
| SCHEMBL21623888 | 0.74 | CA2 (0.40) | HDAC7HDAC8HDAC6HDAC9HDAC5 | |
| SCHEMBL22551588 | 0.74 | TP53 (0.42) | TSHRCA1CA2CA7CA14 | |
| SCHEMBL28044631 | 0.74 | CYP2C9 (0.41) | HDAC7HDAC8HDAC6HDAC9HDAC5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1744745-A4 | PHARMACEUTICAL NITRONES | CHILDRENS HOSP & RES CT OAK (US) | 2007-06-06 | — | — | EP | disclosed |
| EP-1744745-A1 | PHARMACEUTICAL NITRONES | Children's Hospital & Research Center at Oakland (US) | 2007-01-24 | — | — | EP | disclosed |
| WO-2005110401-A1 | PHARMACEUTICAL NITRONES | CHILDREN'S HOSPITAL & RESEARCH CENTER AT OAKLAND (US) | 2005-11-24 | — | — | WO | disclosed |