Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Amiodarone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 known ✓ | Q12809 | 1/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.64 |
| ▸ | TP53 | P04637 | 2/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.64 |
| ▸ | MEN1 | O00255 | 1/20 | 0.64 |
| ▸ | GMNN | O75496 | 1/20 | 0.64 |
| ▸ | LMNA | P02545 | 1/20 | 0.64 |
| ▸ | MAPT | P10636 | 1/20 | 0.64 |
| ▸ | BLM | P54132 | 1/20 | 0.64 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.64 |
| ▸ | ATM | Q13315 | 1/20 | 0.64 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.64 |
| ▸ | SIRT3 | Q9NTG7 | 9/20 | 0.63 |
| ▸ | KDM5A | P29375 | 7/20 | 0.63 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.63 |
| ▸ | THRA | P10827 | 2/20 | 0.63 |
| ▸ | THRB | P10828 | 2/20 | 0.63 |
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 | |
|---|---|---|---|---|
| Amiodarone SCHEMBL41348 | 0.80 | ALDH1A1 (1.00) | ALDH1A1TP53CYP3A4SMN1; SMN2TDP1 | |
| Amiodarone SCHEMBL29362650 | 0.80 | ALDH1A1 (1.00) | ALDH1A1TP53CYP3A4SMN1; SMN2TDP1 | |
| Amiodarone SCHEMBL28989964 | 0.79 | ALDH1A1 (0.98) | ALDH1A1TP53CYP3A4SMN1; SMN2TDP1 | |
| Amiodarone SCHEMBL28184969 | 0.79 | SIRT3 (0.96) | ALDH1A1TP53CYP3A4SMN1; SMN2TDP1 | |
| Amiodarone SCHEMBL29361787 | 0.79 | SIRT3 (1.00) | ALDH1A1TP53CYP3A4SMN1; SMN2TDP1 | |
| Amiodarone SCHEMBL16284 | 0.79 | SIRT3 (1.00) | ALDH1A1TP53CYP3A4SMN1; SMN2TDP1 | |
| Amiodarone SCHEMBL5496372 | 0.79 | SIRT3 (1.00) | ALDH1A1TP53CYP3A4SMN1; SMN2TDP1 | |
| Amiodarone SCHEMBL12487240 | 0.79 | SIRT3 (1.00) | ALDH1A1TP53CYP3A4SMN1; SMN2TDP1 | |
| Amiodarone SCHEMBL29173757 | 0.79 | SIRT3 (0.98) | ALDH1A1TP53CYP3A4SMN1; SMN2TDP1 | |
| Amiodarone SCHEMBL29183902 | 0.79 | SIRT3 (0.98) | ALDH1A1TP53CYP3A4SMN1; SMN2TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2427178-A2 | DERMAL DELIVERY COMPOSITIONS COMPRISING ACTIVE AGENT-CALCIUM PHOSPHATE PARTICLE COMPLEXES AND METHODS OF USING THE SAME | Laboratory Skin Care, Inc. (US) | 2012-03-14 | — | — | EP | disclosed |
| WO-2010129819-A2 | DERMAL DELIVERY COMPOSITIONS COMPRISING ACTIVE AGENT-CALCIUM PHOSPHATE PARTICLE COMPLEXES AND METHODS OF USING THE SAME | LABORATORY SKIN CARE, INC. (US) | 2010-11-11 | — | — | WO | disclosed |