Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 4/20 | 0.40 |
| ▸ | CTSS | P25774 | 5/20 | 0.40 |
| ▸ | CTSL | P07711 | 3/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9255461 | 0.90 | HDAC6 (0.42) | HDAC6HDAC1HDAC8CTSSCTSL | |
| SCHEMBL9246045 | 0.86 | HDAC6 (0.51) | HDAC6HDAC1HDAC8HDAC3HDAC2 | |
| SCHEMBL9252253 | 0.85 | HDAC6 (0.46) | HDAC6HDAC1HDAC8MAPTHDAC3 | |
| SCHEMBL9253879 | 0.84 | HDAC6 (0.46) | HDAC6HDAC1HDAC8CTSKHDAC3 | |
| SCHEMBL9252703 | 0.84 | ENPP2 (0.39) | HDAC6THRBTP53CTSSCTSL | |
| SCHEMBL9251560 | 0.82 | ITGB3 (0.47) | HDAC6HDAC1HDAC8THRBTP53 | |
| SCHEMBL8886008 | 0.82 | MAPT (0.49) | TP53CTSSCTSLCTSKMAPT | |
| SCHEMBL8408125 | 0.76 | CTSL (0.41) | CTSSCTSLCTSKMAPTSMN1; SMN2 | |
| SCHEMBL11714376 | 0.75 | CTSK (0.61) | HDAC8CTSSCTSLCTSKMAPT | |
| SCHEMBL7331480 | 0.74 | ITGB3 (0.42) | CTSSCTSLCTSKMAPTSMN1; SMN2 |
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 |