Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 7/20 | 0.90 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.90 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.90 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.90 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.90 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.90 |
| ▸ | MEN1 | O00255 | 3/20 | 0.90 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.90 |
| ▸ | LMNA | P02545 | 3/20 | 0.90 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.90 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.90 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.90 |
| ▸ | TP53 | P04637 | 2/20 | 0.90 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.90 |
| ▸ | MAPT | P10636 | 2/20 | 0.90 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.90 |
| ▸ | TSHR | P16473 | 2/20 | 0.90 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.90 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.90 |
| ▸ | THPO | P40225 | 2/20 | 0.90 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11374533 | 0.99 | SLC6A4 (0.90) | SLC6A4SLC6A3SLC6A2SMN1; SMN2SIGMAR1 | |
| SCHEMBL10000765 | 0.96 | SLC6A4 (0.97) | SLC6A4SLC6A3SLC6A2SMN1; SMN2SIGMAR1 | |
| Vanoxerine SCHEMBL246574 | 0.95 | SLC6A4 (1.00) | SLC6A4SLC6A3SLC6A2SMN1; SMN2SIGMAR1 | |
| Vanoxerine SCHEMBL725103 | 0.94 | SLC6A4 (1.00) | SLC6A4SLC6A3SLC6A2SMN1; SMN2SIGMAR1 | |
| Vanoxerine SCHEMBL15541249 | 0.94 | SLC6A4 (1.00) | SLC6A4SLC6A3SLC6A2SMN1; SMN2SIGMAR1 | |
| Vanoxerine SCHEMBL3014060 | 0.92 | SLC6A4 (0.95) | SLC6A4SLC6A3SLC6A2SMN1; SMN2SIGMAR1 | |
| Hydrochloric Acid SCHEMBL11380714 | 0.92 | SLC6A4 (0.88) | SLC6A4SLC6A3SLC6A2SMN1; SMN2SIGMAR1 | |
| SCHEMBL726349 | 0.90 | SLC6A2 (1.00) | SLC6A4SLC6A3SLC6A2SMN1; SMN2SIGMAR1 | |
| SCHEMBL24221220 | 0.89 | SLC6A4 (0.88) | SLC6A4SLC6A3SLC6A2SMN1; SMN2SIGMAR1 | |
| Hydrochloric Acid SCHEMBL339982 | 0.89 | SMN1; SMN2 (1.00) | SLC6A4SLC6A3SLC6A2SMN1; SMN2SIGMAR1 |
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-2005067931-A2 | DOPAMINE UPTAKE INHIBITORS FOR THE TREATMENT OF NEUROLOGICAL DISEASE | DANIOLABS LIMITED (GB) | 2005-07-28 | — | — | WO | disclosed |