Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 9/20 | 0.59 |
| ▸ | EGFR | P00533 | 9/20 | 0.59 |
| ▸ | HDAC4 | P56524 | 9/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 9/20 | 0.59 |
| ▸ | HDAC7 | Q8WUI4 | 9/20 | 0.59 |
| ▸ | HDAC2 | Q92769 | 9/20 | 0.59 |
| ▸ | HDAC10 | Q969S8 | 9/20 | 0.59 |
| ▸ | HDAC11 | Q96DB2 | 9/20 | 0.59 |
| ▸ | HDAC8 | Q9BY41 | 9/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 9/20 | 0.59 |
| ▸ | HDAC9 | Q9UKV0 | 9/20 | 0.59 |
| ▸ | HDAC5 | Q9UQL6 | 9/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL11212802 | 1.00 | HDAC3 (0.59) | HDAC3EGFRHDAC4HDAC1HDAC7 | |
| SCHEMBL11203184 | 1.00 | HDAC3 (0.59) | HDAC3EGFRHDAC4HDAC1HDAC7 | |
| SCHEMBL11218084 | 1.00 | HDAC3 (0.59) | HDAC3EGFRHDAC4HDAC1HDAC7 | |
| SCHEMBL11200379 | 1.00 | HDAC3 (0.59) | HDAC3EGFRHDAC4HDAC1HDAC7 | |
| SCHEMBL11214314 | 0.99 | HDAC3 (0.57) | HDAC3EGFRHDAC4HDAC1HDAC7 | |
| SCHEMBL11322282 | 0.88 | HDAC3 (0.58) | HDAC3EGFRHDAC4HDAC1HDAC7 | |
| SCHEMBL11939875 | 0.86 | KDM4C (0.60) | HDAC3EGFRHDAC4HDAC1HDAC7 | |
| SCHEMBL10954583 | 0.86 | KDM4C (0.60) | HDAC3EGFRHDAC4HDAC1HDAC7 | |
| SCHEMBL6579751 | 0.86 | ALDH1A1 (0.62) | HDAC3EGFRHDAC4HDAC1HDAC7 | |
| SCHEMBL16131268 | 0.86 | KDM4C (0.60) | HDAC3EGFRHDAC4HDAC1HDAC7 |
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-4409232-A | HYPOTENSIVE AGENTS, ANTIARRHYTHMIA AGENTS | BEIERSDORF AKTIENGESELLSCHAFT (DE) | 1983-10-11 | — | — | US | disclosed |
| EP-0045955-A1 | Alkyl and cycloalkyl substituted 2-(2-(2-hydroxy-3-tert.-butylamino-propoxy)-5-acylaminophenyl)-1,3,4-oxadiazoles, their preparation and pharmaceutical preparations containing them | Beiersdorf Aktiengesellschaft (DE) | 1982-02-17 | — | — | EP | disclosed |