Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 17/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 14/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.44 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11630312 | 0.87 | SLC6A2 (0.57) | SLC6A2SLC6A4TAAR1SLC6A3KCNH2 | |
| SCHEMBL16559322 | 0.87 | SLC6A2 (0.57) | SLC6A2SLC6A4TAAR1SLC6A3KCNH2 | |
| SCHEMBL16552607 | 0.84 | SLC6A2 (0.59) | SLC6A2SLC6A4TAAR1SLC6A3HIF1A | |
| SCHEMBL16552595 | 0.83 | SLC6A2 (0.64) | SLC6A2SLC6A4 | |
| SCHEMBL16552498 | 0.83 | SLC6A2 (0.64) | SLC6A2SLC6A4SLC6A3KCNH2HIF1A | |
| SCHEMBL16552500 | 0.81 | SLC6A4 (0.47) | SLC6A2SLC6A4TAAR1SLC6A3KCNH2 | |
| SCHEMBL16552478 | 0.81 | SLC6A2 (0.62) | SLC6A2SLC6A4KDM4E | |
| SCHEMBL16552551 | 0.79 | SLC6A2 (0.56) | SLC6A2SLC6A4SLC6A3HIF1AADRB2 | |
| SCHEMBL11633746 | 0.79 | SLC6A2 (0.60) | SLC6A2SLC6A4TAAR1SLC6A3CYP2D6 | |
| SCHEMBL16559342 | 0.78 | SLC6A2 (0.60) | SLC6A2SLC6A4SLC6A3KCNH2HIF1A |
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-105764904-A | Aza-pyridone compounds and uses thereof | 艾丽奥斯生物制药有限公司 | 2016-07-13 | — | — | CN | disclosed |