Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 6/20 | 0.43 |
| ▸ | DRD2 | P14416 | 4/20 | 0.43 |
| ▸ | HTR2A | P28223 | 4/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | HTR3A | P46098 | 2/20 | 0.38 |
| ▸ | PLK1 | P53350 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.37 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.37 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6890118 | 0.81 | HTR2C (0.40) | HTR1ADRD2HTR2ADRD4HTR2C | |
| SCHEMBL1742847 | 0.79 | ADRB1 (0.51) | HTR1ADRD2HTR2ADRD3ADRB1 | |
| SCHEMBL5666319 | 0.78 | HTR1A (0.47) | HTR1ADRD2HTR2ADRD4HTR2C | |
| SCHEMBL14648299 | 0.76 | L3MBTL1 (0.42) | HTR1ADRD2HTR2ADRD4DRD3 | |
| SCHEMBL13281046 | 0.75 | GAA (0.42) | HTR1ADRD2HTR2ADRD4HTR2C | |
| SCHEMBL2228895 | 0.75 | CXCR5 (0.53) | CYP2C9PLK1 | |
| SCHEMBL29227952 | 0.74 | ADRB1 (0.41) | HTR1ADRD2HTR2ADRD4HTR2C | |
| SCHEMBL5915129 | 0.73 | HTR1A (0.54) | HTR1ADRD2HTR2ADRD4HTR2C | |
| SCHEMBL29227951 | 0.73 | ADRB1 (0.42) | HTR1ADRD2HTR2ADRD4HTR2C | |
| SCHEMBL27778033 | 0.72 | PLK1 (0.46) | CYP2C9PLK1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1232513-C | 1-[1-(hetero) aryl-1-perhydroxyalkylmethyl]-piperazine compound, preparation thereof and pharmaceutics containing it | SOLVAY PHARM GMBH (DE) | 2005-12-21 | — | — | CN | claimed |
| CN-1406937-A | 1-[1-(hetero) aryl-1-perhydroxyalkylmethyl]-piperazine compound, preparation thereof and pharmaceutics containing it | SOLVAY PHARM GMBH (DE) | 2003-04-02 | — | — | CN | claimed |
| CN-1232513-C | 1-[1-(hetero) aryl-1-perhydroxyalkylmethyl]-piperazine compound, preparation thereof and pharmaceutics containing it | SOLVAY PHARM GMBH (DE) | 2005-12-21 | — | — | CN | disclosed |
| US-6770649-B2 | PIPERIZINE COMPOUNDS USEFUL FOR TREATING IRRITABLE BOWEL SYNDROME | SOLVAY PHARMACEUTICALS GMBH (DE) | 2004-08-03 | — | — | US | disclosed |
| CN-1406937-A | 1-[1-(hetero) aryl-1-perhydroxyalkylmethyl]-piperazine compound, preparation thereof and pharmaceutics containing it | SOLVAY PHARM GMBH (DE) | 2003-04-02 | — | — | CN | disclosed |