Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.37 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.36 |
| ▸ | WNT3A | P56704 | 1/20 | 0.36 |
| ▸ | F7 | P08709 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | F3 | P13726 | 1/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.36 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.36 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
| ▸ | MET | P08581 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.35 |
| ▸ | AKT2 | P31751 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27838232 | 0.81 | SLC6A2 (0.63) | SLC6A2SLC6A4SLC6A3NPC1PTGS2 | |
| SCHEMBL13181951 | 0.80 | SLC6A2 (0.56) | SLC6A2SLC6A4SLC6A3NPC1PTGS2 | |
| SCHEMBL2306870 | 0.78 | SLC6A2 (0.68) | SLC6A2SLC6A4SLC6A3NPC1PTGS2 | |
| SCHEMBL28772430 | 0.75 | SLC6A2 (0.63) | SLC6A2SLC6A4SLC6A3NPC1PTGS2 | |
| SCHEMBL2305292 | 0.71 | SLC6A2 (0.59) | SLC6A2SLC6A4SLC6A3NPC1PTGS2 | |
| SCHEMBL2300668 | 0.71 | SLC6A2 (0.75) | SLC6A2SLC6A4SLC6A3NPC1PTGS2 | |
| SCHEMBL12427122 | 0.71 | SLC6A2 (0.59) | SLC6A2SLC6A4SLC6A3NPC1PTGS2 | |
| SCHEMBL2305815 | 0.71 | SLC6A2 (0.58) | SLC6A2SLC6A4SLC6A3NPC1PTGS2 | |
| SCHEMBL2305970 | 0.69 | SLC6A2 (0.67) | SLC6A2SLC6A4SLC6A3NPC1PTGS2 | |
| SCHEMBL2302666 | 0.69 | SLC6A4 (1.00) | SLC6A2SLC6A4SLC6A3NPC1PTGS2 |
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-2351737-A1 | 3-Amino-1-arylpropyl indoles and aza-substituted indoles | F. Hoffmann-La Roche AG (CH) | 2011-08-03 | — | — | EP | disclosed |
| US-7446118-B2 | 3-amino-1-arylpropyl indoles and aza-substituted indoles and uses thereof | ROCHE PALO ALTO LLC (US) | 2008-11-04 | — | — | US | disclosed |