Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 6/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.34 |
| ▸ | QDPR | P09417 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.32 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.32 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL543076 | 0.92 | KDM1A (0.40) | HDAC1HDAC2HDAC3BACE1ESR2 | |
| SCHEMBL10627717 | 0.90 | BACE1 (0.49) | HDAC1HDAC2HDAC3BACE1ACMSD | |
| SCHEMBL26772807 | 0.86 | CHRNB2 (0.41) | HDAC1HDAC2HDAC3QDPRKCNH2 | |
| SCHEMBL26165322 | 0.86 | QDPR (0.54) | HDAC1HDAC2HDAC3ESR2QDPR | |
| SCHEMBL6940702 | 0.82 | HDAC2 (0.38) | HDAC1HDAC2HDAC3BACE1ESR2 | |
| SCHEMBL25541093 | 0.82 | QDPR (0.49) | BACE1QDPRKCNH2HRH4HRH3 | |
| SCHEMBL843886 | 0.81 | HDAC1 (0.44) | HDAC1HDAC2HDAC3BACE1ESR2 | |
| SCHEMBL24073469 | 0.80 | HDAC1 (0.41) | HDAC1HDAC2HDAC3BACE1ESR2 | |
| SCHEMBL26755668 | 0.79 | CHRNB2 (0.44) | POLBIKBKETBK1CYP3A4 | |
| SCHEMBL20392762 | 0.76 | NOS3 (0.43) | POLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1101756-B1 | Aminopyrrolidine derivatives, processes for their preparation and pharmaceutical compositions comprising them | SERVIER LAB (FR) | 2003-03-19 | — | — | EP | disclosed |
| US-6300366-B1 | FOR THERAPY OF CARDIOVASCULAR DISEASES, ESPECIALLY ARTERIAL HYPERTENSION, ARRHYTHMIA | ADIR ET COMPAGNIE (FR) | 2001-10-09 | — | — | US | disclosed |
| EP-1101756-A1 | Aminopyrrolidine derivatives, processes for their preparation and pharmaceutical compositions comprising them | ADIR ET COMPAGNIE (FR) | 2001-05-23 | — | — | EP | disclosed |