Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 5/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.35 |
| ▸ | HTR1A | P08908 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2586271 | 0.77 | GABRA1 (0.47) | GABRA1GABRB2ALDH1A1ADRA2CADRB2 | |
| SCHEMBL8755334 | 0.73 | GABRA1 (0.42) | GABRA1GABRB2ALDH1A1ADRA2CHTR1A | |
| SCHEMBL6132056 | 0.72 | MAPT (0.41) | GABRA1GABRB2HTR1ALMNAADRA1A | |
| SCHEMBL25440099 | 0.72 | L3MBTL1 (0.42) | ALDH1A1LMNATSHRGAAKDM4E | |
| SCHEMBL6131909 | 0.72 | CA2 (0.37) | ALDH1A1HTR1ALMNATSHRNFKB1 | |
| Hydrochloric Acid SCHEMBL29044792 | 0.72 | GABRA1 (0.41) | GABRA1GABRB2ALDH1A1ADRA2CHTR1A | |
| Alcohol SCHEMBL876107 | 0.70 | GABRA1 (0.52) | GABRA1GABRB2ALDH1A1ADRA2CADRB2 | |
| SCHEMBL3675862 | 0.70 | GABRA1 (0.40) | GABRA1GABRB2ALDH1A1ADRA2CHTR1A | |
| SCHEMBL4189715 | 0.70 | GABRA1 (0.40) | GABRA1GABRB2ALDH1A1ADRA2CHTR1A | |
| SCHEMBL3951579 | 0.70 | GABRA1 (0.41) | GABRA1GABRB2ALDH1A1ADRA2CLMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1032559-A4 | AMINOALKYLPHENOL DERIVATIVES AND RELATED COMPOUNDS | AVENTIS PHARMA INC (US) | 2005-05-25 | — | — | EP | disclosed |
| EP-1032559-A1 | AMINOALKYLPHENOL DERIVATIVES AND RELATED COMPOUNDS | AVENTIS PHARMACEUTICALS INC. (US) | 2000-09-06 | — | — | EP | disclosed |
| WO-1999016746-A1 | AMINOALKYLPHENOL DERIVATIVES AND RELATED COMPOUNDS | AVENTIS PHARMACEUTICALS INC. (US) | 1999-04-08 | — | — | WO | disclosed |