Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.47 |
| ▸ | MAOB | P27338 | 4/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.44 |
| ▸ | HTT | P42858 | 4/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL12119911 | 1.00 | MAOA (0.47) | MAOAMAOBACHEBACE1BRD4 | |
| SCHEMBL113669 | 0.84 | BRD4 (0.48) | MAOAMAOBACHEBACE1BRD4 | |
| SCHEMBL112274 | 0.84 | BRD4 (0.48) | MAOAMAOBACHEBACE1BRD4 | |
| SCHEMBL113635 | 0.84 | BRD4 (0.48) | MAOAMAOBACHEBACE1BRD4 | |
| SCHEMBL12119901 | 0.78 | BRD4 (0.53) | BRD4KDM4EHTTL3MBTL1NPC1 | |
| SCHEMBL113620 | 0.74 | MAOA (0.53) | MAOAMAOBACHEBACE1BRD4 | |
| SCHEMBL112261 | 0.74 | MAOA (0.53) | MAOAMAOBACHEBACE1BRD4 | |
| SCHEMBL113766 | 0.74 | MAOA (0.53) | MAOAMAOBACHEBACE1BRD4 | |
| SCHEMBL112199 | 0.74 | MAOA (0.80) | MAOAMAOBACHEBACE1KDM4E | |
| SCHEMBL12119930 | 0.72 | SLC17A5 (0.44) | BRD4KDM4EHTTL3MBTL1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8058442-B2 | Neuroprotective iron chelators and pharmaceutical compositions comprising them | TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) | 2011-11-15 | — | — | US | disclosed |