Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A2 | Q05940 | 14/20 | 1.00 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 1.00 |
| ▸ | HTR2A | P28223 | 3/20 | 1.00 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | HTR1A | P08908 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | DRD2 | P14416 | 1/20 | 0.58 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.58 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.58 |
| ▸ | DRD1 | P21728 | 1/20 | 0.58 |
| ▸ | DRD4 | P21917 | 1/20 | 0.58 |
| ▸ | HTR1D | P28221 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL19483241 | 1.00 | SLC18A2 (1.00) | SLC18A2SLC6A3HTR2AKCNH2ALDH1A1 | |
| SCHEMBL17486597 | 1.00 | SLC18A2 (1.00) | SLC18A2SLC6A3HTR2AKCNH2ALDH1A1 | |
| SCHEMBL17486601 | 1.00 | SLC18A2 (1.00) | SLC18A2SLC6A3HTR2AKCNH2ALDH1A1 | |
| SCHEMBL17474531 | 1.00 | SLC18A2 (1.00) | SLC18A2SLC6A3HTR2AKCNH2ALDH1A1 | |
| SCHEMBL17486641 | 0.95 | SLC18A2 (0.91) | SLC18A2SLC6A3HTR2AKCNH2ALDH1A1 | |
| SCHEMBL17485176 | 0.95 | SLC18A2 (0.91) | SLC18A2SLC6A3HTR2AKCNH2ALDH1A1 | |
| SCHEMBL17486594 | 0.93 | SLC18A2 (1.00) | SLC18A2SLC6A3HTR2AKCNH2ALDH1A1 | |
| SCHEMBL17486624 | 0.93 | SLC18A2 (1.00) | SLC18A2SLC6A3HTR2AKCNH2ALDH1A1 | |
| SCHEMBL19484663 | 0.93 | SLC18A2 (1.00) | SLC18A2SLC6A3HTR2AMAPTHSD17B10 | |
| SCHEMBL17486625 | 0.93 | SLC18A2 (1.00) | SLC18A2SLC6A3HTR2AMAPTHSD17B10 |
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-3174864-A2 | VMAT INHIBITORY COMPOUNDS | Oregon Health & Science University (US) | 2017-06-07 | — | — | EP | disclosed |
| WO-2016019312-A2 | VMAT INHIBITORY COMPOUNDS | OREGON HEALTH & SCIENCE UNIVERSITY (US) | 2016-02-04 | — | — | WO | disclosed |