Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 17/20 | 0.78 |
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.72 |
| ▸ | HTR1A | P08908 | 4/20 | 0.65 |
| ▸ | DRD2 | P14416 | 4/20 | 0.65 |
| ▸ | BCHE | P06276 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL7428563 | 0.97 | ABCB1 (0.74) | ABCB1ABCG2HTR1ADRD2BCHE | |
| Ethylamine SCHEMBL7428437 | 0.93 | ABCB1 (0.69) | ABCB1ABCG2HTR1ADRD2BCHE | |
| Acetonitrile SCHEMBL7433999 | 0.93 | ABCB1 (0.69) | ABCB1ABCG2HTR1ADRD2BCHE | |
| Methyl Alcohol SCHEMBL7429096 | 0.88 | ABCB1 (0.63) | ABCB1ABCG2HTR1ADRD2BCHE | |
| Methyl Alcohol SCHEMBL7430978 | 0.88 | ABCB1 (0.63) | ABCB1ABCG2HTR1ADRD2BCHE | |
| Methyl Alcohol SCHEMBL7443710 | 0.86 | ABCB1 (0.61) | ABCB1ABCG2HTR1ADRD2 | |
| Acetonitrile SCHEMBL7437702 | 0.85 | ABCB1 (0.59) | ABCB1ABCG2HTR1ADRD2BCHE | |
| Ethylamine SCHEMBL7436575 | 0.85 | ABCB1 (0.59) | ABCB1ABCG2HTR1ADRD2BCHE | |
| Ethylamine SCHEMBL7440936 | 0.85 | ABCB1 (0.59) | ABCB1ABCG2HTR1ADRD2BCHE | |
| SCHEMBL21030103 | 0.83 | ABCB1 (0.77) | ABCB1ABCG2HTR1ADRD2BCHE |
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-0314725-A1 | 2-(3,4-DIHYDROXYPHENYL)ETHYLAMINES, THEIR PREPARATION AND USE AS PHARMACEUTICAL | FISONS plc (GB) | 1989-05-10 | — | — | EP | disclosed |
| WO-1988009326-A1 | 2-(3,4-DIHYDROXYPHENYL)ETHYLAMINES, THEIR PREPARATION AND USE AS PHARMACEUTICAL | FISONS PLC (GB) | 1988-12-01 | — | — | WO | disclosed |
| EP-0292202-A1 | 2-(3,4-Dihydroxyphenyl ethyl amines, their preparation and use as pharmaceutical compounds | FISONS plc (GB) | 1988-11-23 | — | — | EP | disclosed |