Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 8/20 | 0.64 |
| ▸ | HDAC4 | P56524 | 8/20 | 0.64 |
| ▸ | HDAC1 | Q13547 | 8/20 | 0.64 |
| ▸ | HDAC7 | Q8WUI4 | 8/20 | 0.64 |
| ▸ | HDAC2 | Q92769 | 8/20 | 0.64 |
| ▸ | HDAC10 | Q969S8 | 8/20 | 0.64 |
| ▸ | HDAC11 | Q96DB2 | 8/20 | 0.64 |
| ▸ | HDAC8 | Q9BY41 | 8/20 | 0.64 |
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.64 |
| ▸ | HDAC9 | Q9UKV0 | 8/20 | 0.64 |
| ▸ | HDAC5 | Q9UQL6 | 8/20 | 0.64 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | PGR | P06401 | 1/20 | 0.58 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.58 |
| ▸ | MAOA | P21397 | 1/20 | 0.58 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.58 |
| ▸ | NPY1R | P25929 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL28820748 | 0.78 | HDAC3 (0.64) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL16856765 | 0.78 | HDAC6 (0.64) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL8457651 | 0.78 | HDAC3 (0.64) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL596141 | 0.77 | HDAC3 (0.63) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL17849753 | 0.74 | HDAC8 (0.59) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL17849758 | 0.71 | HDAC3 (0.46) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL9662799 | 0.69 | IKBKB (0.37) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| Anetholtrithion SCHEMBL561178 | 0.69 | MEN1 (0.87) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL31493191 | 0.67 | HDAC3 (0.59) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL31493224 | 0.67 | HDAC3 (0.59) | HDAC3HDAC4HDAC1HDAC7HDAC2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0343573-B1 | MEDICINES CONTAINING 1,2-DITHIOL-3-THION-S-OXYDE COMPOUNDS | Kali-Chemie Pharma GmbH (DE) | 1993-08-04 | — | — | EP | disclosed |
| US-5096920-A | Liver disorders | KALI-CHEMIE PHARMA GMBH (DE) | 1992-03-17 | — | — | US | disclosed |
| EP-0343573-A1 | Medicines containing 1,2-dithiol-3-thion-S-oxyde compounds | Kali-Chemie Pharma GmbH (DE) | 1989-11-29 | — | — | EP | disclosed |
| EP-0343303-A1 | Medicines containing 1,2-dithiol-3-thion-S-oxide compounds | Kali-Chemie Pharma GmbH (DE) | 1989-11-29 | — | — | EP | disclosed |