Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 2/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | RAD52 | P43351 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PDE2A | O00408 | 1/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7346953 | 0.79 | ADRB2 (0.42) | ADRB2ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL24370395 | 0.79 | KCNH2 (0.52) | ADRB2ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL7356102 | 0.77 | CYP3A4 (0.37) | ADRB2ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL7352557 | 0.77 | HTR1A (0.36) | — | |
| SCHEMBL7352348 | 0.77 | MEN1 (0.41) | ADRB2KDM4EMAPTTDP1 | |
| SCHEMBL7353468 | 0.75 | ALDH1A1 (0.34) | HSD17B10MAPTPDE2A | |
| SCHEMBL7347249 | 0.74 | HTT (0.44) | KDM4ETDP1 | |
| SCHEMBL16371920 | 0.73 | CES2 (0.43) | ADRB2ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL1349872 | 0.73 | PDE2A (0.42) | ADRB2ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL7352509 | 0.73 | ALDH1A1 (0.44) | HSD17B10MAPTNPSR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0972764-A1 | Aminoalcohols and aminoketones as CNS active agents | Universita Degli Studi di Firenze (IT) | 2000-01-19 | — | — | EP | claimed |
| EP-0972764-A1 | Aminoalcohols and aminoketones as CNS active agents | Universita Degli Studi di Firenze (IT) | 2000-01-19 | — | — | EP | disclosed |