Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 6/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3825446 | 0.85 | KMT2A (0.31) | TAAR1KMT2A | |
| SCHEMBL128086 | 0.80 | TAAR1 (0.35) | TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3016224 | 0.79 | SIGMAR1 (0.45) | TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL27932397 | 0.79 | TAAR1 (0.34) | TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9330630 | 0.79 | TAAR1 (0.34) | TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2555409 | 0.78 | SIGMAR1 (0.56) | TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL13006663 | 0.78 | SIGMAR1 (0.56) | TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL13189946 | 0.78 | SIGMAR1 (0.56) | TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL1452706 | 0.77 | — | — | |
| SCHEMBL3616684 | 0.77 | TAAR1 (0.33) | TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3 |
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-101641012-A | Agricultural composition for controlling or preventing plant diseases caused by plant pathogenic microbes | SUMITOMO CHEMICAL CO JP | 2010-02-03 | — | — | CN | disclosed |