Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 3/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 7/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | NCF1 | P14598 | 1/20 | 0.40 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13361845 | 0.80 | ADRB1 (0.59) | ADRB1KDM4EALDH1A1ACHEROCK2 | |
| SCHEMBL8983629 | 0.78 | ADRB1 (0.52) | ADRB1KDM4EALDH1A1ACHEROCK2 | |
| SCHEMBL24920523 | 0.77 | ADRB1 (0.51) | ADRB1KDM4EALDH1A1ACHEROCK2 | |
| SCHEMBL5758330 | 0.74 | ADRB1 (0.59) | ADRB1KDM4EALDH1A1ACHEROCK2 | |
| Hydrochloric Acid SCHEMBL8880842 | 0.74 | CETP (0.52) | ADRB1KDM4EALDH1A1ACHEROCK2 | |
| SCHEMBL5330907 | 0.74 | CETP (0.49) | ADRB1KDM4EALDH1A1ACHEROCK2 | |
| SCHEMBL3294901 | 0.73 | HRH3 (0.55) | ADRB1KDM4EALDH1A1HRH3PLD1 | |
| Hydrochloric Acid SCHEMBL4815955 | 0.73 | ALDH1A1 (0.59) | ADRB1KDM4EALDH1A1ACHEROCK2 | |
| SCHEMBL11113633 | 0.73 | ADRB1 (0.61) | ADRB1KDM4EALDH1A1ACHEROCK2 | |
| SCHEMBL573580 | 0.71 | ADRB1 (0.59) | ADRB1KDM4EALDH1A1ACHEROCK2 |
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-1006110-B1 | DERIVATIVES OF ACYL-PIPERAZINIL-PYRIMIDINS, PREPARATION THEREOF AND APPLICATION AS MEDICAMENTS | ESTEVE LABOR DR (ES) | 2004-02-11 | — | — | EP | disclosed |
| US-6372746-B1 | ANTICONVULSIVE AGENTS, SEDATIVES AND EATING DISORDERS | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2002-04-16 | — | — | US | disclosed |
| EP-1006110-A1 | DERIVATIVES OF ACYL-PIPERAZINIL-PYRIMIDINS, PREPARATION THEREOF AND APPLICATION AS MEDICAMENTS | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2000-06-07 | — | — | EP | disclosed |