Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.54 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA3 | P07451 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2250154 | 0.88 | HDAC6 (0.45) | HDAC6HDAC8HDAC3HDAC1HDAC2 | |
| SCHEMBL10965597 | 0.84 | HDAC6 (0.48) | HDAC6HDAC8HDAC3HDAC1HDAC2 | |
| SCHEMBL16901843 | 0.82 | HDAC6 (0.51) | HDAC6HDAC8HDAC3HDAC1HDAC2 | |
| SCHEMBL17689078 | 0.80 | HDAC6 (0.49) | HDAC6HDAC8HDAC3HDAC1HDAC2 | |
| SCHEMBL11487550 | 0.78 | TBXAS1 (0.52) | HDAC6HDAC8HDAC3HDAC1HDAC2 | |
| SCHEMBL10968349 | 0.77 | PRMT6 (0.44) | HDAC6HDAC8HDAC3HDAC1HDAC2 | |
| SCHEMBL16901833 | 0.77 | HDAC6 (0.47) | HDAC6HDAC8HDAC3HDAC1HDAC2 | |
| SCHEMBL7315600 | 0.75 | HRH3 (0.50) | HDAC6HDAC8HDAC3HDAC1HDAC2 | |
| SCHEMBL9653426 | 0.75 | CYP19A1 (0.59) | HDAC6L3MBTL1KDM4EALDH1A1TDP1 | |
| SCHEMBL7545069 | 0.75 | DRD4 (0.68) | L3MBTL1KDM4EALDH1A1DRD4CA12 |
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-0029311-B1 | AMINOALKYL BENZOFURAN DERIVATIVES, THEIR PRODUCTION AND COMPOSITIONS CONTAINING THEM | MERCK & CO. INC. (US) | 1985-01-23 | — | — | EP | disclosed |
| EP-0029311-A1 | Aminoalkyl benzofuran derivatives, their production and compositions containing them | MERCK & CO. INC. (US) | 1981-05-27 | — | — | EP | disclosed |
| US-4238487-A | ANTISECRETORY AGENTS | MERCK & CO., INC. (US) | 1980-12-09 | — | — | US | disclosed |