Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.50 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.47 |
| ▸ | SMO | Q99835 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.41 |
| ▸ | MCOLN2 | Q8IZK6 | 1/20 | 0.41 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.41 |
| ▸ | MCOLN1 | Q9GZU1 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28286738 | 0.84 | SLC18A3 (0.61) | SLC18A3CXCR3SMOMAOAMAOB | |
| SCHEMBL30823779 | 0.84 | SLC18A3 (0.50) | SLC18A3CXCR3SMOMAOAMAOB | |
| SCHEMBL8434677 | 0.81 | MAOA (0.60) | SLC18A3CXCR3SMOMAOAMAOB | |
| SCHEMBL10263767 | 0.81 | SLC18A3 (0.67) | SLC18A3CXCR3SMOMAOAMAOB | |
| SCHEMBL27781945 | 0.80 | SLC18A3 (0.65) | SLC18A3CXCR3MAOAMAOBMCOLN2 | |
| SCHEMBL2657988 | 0.77 | SLC18A3 (0.53) | SLC18A3CXCR3SMOMAOAMAOB | |
| SCHEMBL9115585 | 0.77 | SLC18A3 (0.53) | SLC18A3CXCR3SMOMAOAMAOB | |
| SCHEMBL29501341 | 0.77 | SLC18A3 (0.53) | SLC18A3CXCR3SMOMAOAMAOB | |
| SCHEMBL2299038 | 0.77 | SLC18A3 (0.53) | SLC18A3CXCR3SMOMAOAMAOB | |
| SCHEMBL8259450 | 0.76 | HRH3 (0.50) | SLC18A3CXCR3SMOMAOAMAOB |
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-2020165031-A1 | SUBSTITUTED ISOQUINOLINE-PIPERIDINYLMETHANONE DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2020-08-20 | — | — | WO | disclosed |