Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 11/20 | 0.80 |
| ▸ | MAOB | P27338 | 8/20 | 0.80 |
| ▸ | BCHE | P06276 | 4/20 | 0.66 |
| ▸ | ACHE | P22303 | 4/20 | 0.66 |
| ▸ | BACE1 | P56817 | 1/20 | 0.66 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.66 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL30035634 | 0.79 | MAOA (1.00) | MAOAMAOBBCHEACHEBACE1 | |
| SCHEMBL6847307 | 0.79 | MAOA (1.00) | MAOAMAOBBCHEACHEBACE1 | |
| SCHEMBL6846347 | 0.77 | MAOA (0.92) | MAOAMAOBBCHEACHEBACE1 | |
| SCHEMBL4020908 | 0.76 | MEN1 (0.66) | MAOAMAOB | |
| SCHEMBL6847527 | 0.71 | MAOA (0.83) | MAOAMAOBBCHEACHEBACE1 | |
| Hydrochloric Acid SCHEMBL7846409 | 0.69 | MAOA (0.58) | MAOAMAOBBCHEACHEBACE1 | |
| SCHEMBL4499901 | 0.69 | CCR3 (0.69) | BCHEACHESIGMAR1 | |
| SCHEMBL4499239 | 0.69 | CCR3 (0.69) | BCHEACHESIGMAR1 | |
| SCHEMBL6847344 | 0.69 | MAOA (0.80) | MAOAMAOBBCHEACHEBACE1 | |
| SCHEMBL6847208 | 0.68 | MAOA (0.78) | MAOAMAOBBCHEACHEBACE1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011113988-A1 | NEW DERIVATIVES OF PROPARGYLAMINE HAVING NEUROPROTECTIVE CAPACITY FOR THE TREATMENT OF ALZHEIMER'S AND PARKINSON'S DISEASES | CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (CSIC) (ES) | 2011-09-22 | — | — | WO | disclosed |