Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.45 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.42 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.39 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 3/20 | 0.38 |
| ▸ | F10 | P00742 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9251091 | 0.91 | NPC1 (0.44) | HDAC1HDAC8HDAC6HDAC3HDAC2 | |
| SCHEMBL9248410 | 0.91 | F2 (0.42) | HDAC1HDAC8HDAC6HDAC3HDAC2 | |
| SCHEMBL9249002 | 0.91 | ITGB3 (0.50) | HDAC1HDAC8HDAC6HDAC3HDAC2 | |
| SCHEMBL8863519 | 0.88 | HDAC1 (0.52) | HDAC1HDAC8HDAC6HDAC3HDAC2 | |
| SCHEMBL9248587 | 0.87 | HDAC6 (0.43) | HDAC1HDAC8HDAC6HDAC3HDAC2 | |
| Hydrochloric Acid SCHEMBL9255053 | 0.87 | HDAC1 (0.51) | HDAC1HDAC8HDAC6HDAC3HDAC2 | |
| SCHEMBL9254163 | 0.86 | KDM4E (0.41) | HDAC1HDAC8HDAC6HDAC3HDAC2 | |
| SCHEMBL9255512 | 0.84 | HDAC1 (0.42) | HDAC1HDAC8HDAC6HDAC3HDAC2 | |
| SCHEMBL9248855 | 0.84 | ITGB3 (0.47) | HDAC1HDAC8HDAC6HDAC3HDAC2 | |
| SCHEMBL9251150 | 0.82 | HDAC1 (0.50) | HDAC1HDAC8HDAC6HDAC3HDAC2 |
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 |