Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.47 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27740328 | 0.90 | SLC6A4 (0.54) | SIGMAR1SLC6A4TAAR1SLC18A2SLC6A2 | |
| SCHEMBL10563491 | 0.76 | HTR2C (0.45) | NPC1RAB9ACYP3A4TSHR | |
| SCHEMBL4883252 | 0.75 | SLC6A4 (0.51) | SIGMAR1SLC6A4TAAR1SLC18A2KDM1A | |
| SCHEMBL14748105 | 0.74 | KCNH2 (0.53) | SLC6A4SLC6A2SLC6A3KDM1AMAOA | |
| SCHEMBL28496737 | 0.74 | KDM1A (0.44) | SLC6A4SLC6A2SLC6A3KDM1AMAOA | |
| SCHEMBL605459 | 0.73 | SLC6A2 (0.63) | SLC6A4SLC6A2SLC6A3KDM1AMAOA | |
| SCHEMBL4766363 | 0.73 | SLC6A2 (0.63) | SLC6A4SLC6A2SLC6A3KDM1AMAOA | |
| SCHEMBL20061148 | 0.73 | SIGMAR1 (0.56) | SIGMAR1SLC6A4TAAR1SLC18A2SLC6A2 | |
| SCHEMBL20061130 | 0.73 | SIGMAR1 (0.56) | SIGMAR1SLC6A4TAAR1SLC18A2SLC6A2 | |
| SCHEMBL239923 | 0.73 | SLC6A2 (0.63) | SLC6A4SLC6A2SLC6A3KDM1AMAOA |
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 |
|---|---|---|---|---|---|---|---|
| CN-108137608-A | Janus kinase 1 selective inhibitor and pharmaceutical application thereof | 阳智化学（株） | 2018-06-08 | — | — | CN | disclosed |