Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.39 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.39 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.39 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.39 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.39 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL26121856 | 1.00 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC18A3TSHRALDH1A1 | |
| SCHEMBL13566530 | 0.90 | OPRM1 (0.50) | SLC6A2SLC6A4SLC18A3ALDH1A1OPRM1 | |
| SCHEMBL26919622 | 0.90 | OPRM1 (0.47) | SLC6A2SLC6A4SLC18A3TSHRALDH1A1 | |
| SCHEMBL13566529 | 0.90 | OPRM1 (0.50) | SLC6A2SLC6A4SLC18A3ALDH1A1OPRM1 | |
| SCHEMBL29218400 | 0.90 | OPRM1 (0.47) | SLC6A2SLC6A4SLC18A3TSHRALDH1A1 | |
| SCHEMBL21948552 | 0.82 | SLC6A2 (0.38) | SLC6A2SLC6A4SLC18A3TSHRALDH1A1 | |
| SCHEMBL14197407 | 0.82 | SLC6A2 (0.48) | SLC6A2SLC6A4 | |
| SCHEMBL728811 | 0.82 | SLC6A2 (0.48) | SLC6A2SLC6A4 | |
| SCHEMBL9759607 | 0.82 | SLC6A2 (0.48) | SLC6A2SLC6A4 | |
| SCHEMBL714998 | 0.82 | SLC6A2 (0.48) | SLC6A2SLC6A4 |
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-118344364-A | Amino-substituted fused heteroaryl compounds, preparation method thereof and application thereof in medicine | 江苏恒瑞医药股份有限公司 | 2024-07-16 | — | — | CN | disclosed |