Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 3/20 | 0.43 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10581074 | 0.84 | HDAC1 (0.58) | HDAC1HDAC8ALDH1A1HPGDHSD17B10 | |
| SCHEMBL10583477 | 0.84 | ALDH1A1 (0.50) | HDAC1HDAC8ALDH1A1HPGDHSD17B10 | |
| SCHEMBL17364184 | 0.81 | ATM (0.45) | HDAC1HDAC8ALDH1A1ATMEGFR | |
| SCHEMBL21872095 | 0.80 | ATM (0.58) | HDAC1HDAC8ALDH1A1ATMEGFR | |
| SCHEMBL9813824 | 0.80 | HDAC1 (0.48) | HDAC1HDAC8ALDH1A1HPGDHSD17B10 | |
| SCHEMBL9813753 | 0.80 | HDAC1 (0.64) | HDAC1HDAC8ALDH1A1HPGDHSD17B10 | |
| SCHEMBL10580558 | 0.79 | ALDH1A1 (0.49) | HDAC1HDAC8ALDH1A1EGFRERBB2 | |
| SCHEMBL2443608 | 0.77 | CA2 (0.51) | HDAC1HDAC8ATMEGFRERBB2 | |
| SCHEMBL21872042 | 0.77 | ATM (0.61) | ALDH1A1ATMEGFRERBB2MEN1 | |
| SCHEMBL1722651 | 0.77 | MEN1 (0.53) | HDAC1HDAC8ALDH1A1ATMEGFR |
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-0301421-B1 | SULFUR COMPOUNDS, PROCESS FOR THEIR PREPARATION AND MEDICINES | Roche Diagnostics GmbH (DE) | 1991-08-28 | — | — | EP | claimed |
| EP-0301421-B1 | SULFUR COMPOUNDS, PROCESS FOR THEIR PREPARATION AND MEDICINES | Roche Diagnostics GmbH (DE) | 1991-08-28 | — | — | EP | disclosed |
| EP-0301421-A2 | Sulfur compounds, process for their preparation and medicines | Roche Diagnostics GmbH (DE) | 1989-02-01 | — | — | EP | disclosed |