Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.54 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.50 |
| ▸ | NAMPT | P43490 | 3/20 | 0.46 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.44 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.42 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | JAK1 | P23458 | 1/20 | 0.41 |
| ▸ | TYK2 | P29597 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9247609 | 0.94 | HDAC6 (0.56) | HDAC6HDAC1HDAC8HDAC3HDAC2 | |
| Bromide SCHEMBL9253343 | 0.93 | HDAC6 (0.55) | HDAC6HDAC1HDAC8HDAC3HDAC2 | |
| SCHEMBL9248594 | 0.90 | HDAC1 (0.50) | HDAC6HDAC1HDAC8HDAC3HDAC2 | |
| SCHEMBL9249572 | 0.88 | ITGB3 (0.56) | HDAC6HDAC1HDAC8HDAC3HDAC2 | |
| Hydrochloric Acid SCHEMBL9252320 | 0.85 | HDAC1 (0.51) | HDAC6HDAC1HDAC8HDAC3HDAC2 | |
| SCHEMBL9257057 | 0.85 | HDAC6 (0.53) | HDAC6HDAC1HDAC8HDAC3HDAC2 | |
| SCHEMBL9255709 | 0.83 | HDAC6 (0.55) | HDAC6HDAC1HDAC8HDAC3HDAC2 | |
| Acetic Acid SCHEMBL9248143 | 0.82 | JAK2 (0.56) | HDAC6HDAC1HDAC8PTGER4JAK2 | |
| SCHEMBL9249490 | 0.82 | HDAC1 (0.56) | HDAC6HDAC1HDAC8HDAC3HDAC2 | |
| Bromide SCHEMBL9248603 | 0.81 | SIRT2 (0.51) | PTGER4TP53MAPTJAK2JAK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5434150-A | Anticoagulants, cardiovascular disorders | DR. KARL THOMAE GMBH (DE) | 1995-07-18 | — | — | US | disclosed |
| EP-0531883-A1 | Condensed 5-membered ring heterocycles, process for their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1993-03-17 | — | — | EP | disclosed |