Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 6/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | LMNA | P02545 | 4/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | MTOR | P42345 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | HTR2C | P28335 | 2/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.53 |
| ▸ | KCNK2 | O95069 | 2/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.53 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL5322154 | 0.88 | SLC6A4 (0.69) | SLC6A4MEN1KMT2ALMNASLC6A2 | |
| SCHEMBL5322164 | 0.88 | SLC6A4 (0.65) | SLC6A4MEN1KMT2ALMNASLC6A2 | |
| SCHEMBL5318556 | 0.87 | SLC6A4 (0.53) | SLC6A4MEN1KMT2ALMNASLC6A2 | |
| Hydrochloric Acid SCHEMBL5351653 | 0.87 | SLC6A4 (0.66) | SLC6A4MEN1KMT2ALMNASLC6A2 | |
| Hydrochloric Acid SCHEMBL5320619 | 0.86 | SLC6A4 (0.54) | SLC6A4MEN1KMT2ALMNASLC6A2 | |
| SCHEMBL4785574 | 0.83 | SLC6A4 (0.76) | SLC6A4MEN1KMT2ALMNASLC6A2 | |
| SCHEMBL8025889 | 0.80 | SLC6A4 (0.76) | SLC6A4MEN1KMT2ALMNASLC6A2 | |
| Oxalic Acid SCHEMBL4739361 | 0.77 | SLC6A4 (0.70) | SLC6A4MEN1KMT2ALMNASLC6A2 | |
| SCHEMBL5322357 | 0.75 | SLC6A4 (0.65) | SLC6A4MEN1KMT2ALMNASLC6A2 | |
| SCHEMBL5323508 | 0.75 | SLC6A4 (0.85) | SLC6A4MEN1KMT2ALMNASLC6A2 |
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-2007095756-A1 | NOVEL CENTRAL-NERVOUS SYSTEM ACTING COMPOUNDS AND METHODS FOR THE TREATMENT OF CNS DISORDERS | CLERA INC. (CA) | 2007-08-30 | — | — | WO | disclosed |