Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 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 | |
|---|---|---|---|---|
| SCHEMBL8521572 | 0.77 | TMEM97 (0.42) | ALDH1A1HDAC1HDAC8HDAC6MEN1 | |
| SCHEMBL7101845 | 0.76 | HDAC8 (0.35) | ALDH1A1HDAC3HDAC1HDAC7HDAC2 | |
| SCHEMBL7101931 | 0.70 | KMT2A (0.41) | KMT2AL3MBTL1KDM4ERORCOPRM1 | |
| SCHEMBL11988645 | 0.69 | NOTUM (0.42) | ALDH1A1HDAC3HDAC1HDAC7HDAC2 | |
| SCHEMBL6491751 | 0.68 | JUN (0.37) | ALDH1A1HDAC3HDAC1HDAC7HDAC2 | |
| SCHEMBL13986666 | 0.67 | NPC1 (0.43) | ALDH1A1HDAC3HDAC1HDAC7HDAC2 | |
| SCHEMBL7262692 | 0.67 | CNR2 (0.42) | ALDH1A1HDAC3HDAC1HDAC7HDAC2 | |
| SCHEMBL11989094 | 0.66 | HRH3 (0.48) | ALDH1A1HDAC3HDAC1HDAC7HDAC2 | |
| SCHEMBL5466561 | 0.65 | CPT2 (0.52) | ALDH1A1MEN1TSHRKMT2AATM | |
| SCHEMBL22719567 | 0.64 | SCN9A (0.48) | ALDH1A1HDAC6L3MBTL1KDM4ELMNA |
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-0925300-A1 | PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE | CAMBRIDGE NEUROSCIENCE, INC. (US) | 1999-06-30 | — | — | EP | claimed |
| EP-0925300-A4 | — | — | 1999-06-30 | — | — | EP | claimed |
| WO-1997030054-A1 | PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE | CAMBRIDGE NEUROSCIENCE, INC. (US) | 1997-08-21 | — | — | WO | claimed |