Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Piperazine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 4/20 | 0.96 |
| ▸ | DRD2 | P14416 | 2/20 | 0.72 |
| ▸ | DRD3 | P35462 | 2/20 | 0.72 |
| ▸ | HTR1A | P08908 | 5/20 | 0.59 |
| ▸ | HTR3A | P46098 | 4/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.59 |
| ▸ | HTR7 | P34969 | 4/20 | 0.56 |
| ▸ | HTR6 | P50406 | 3/20 | 0.56 |
| ▸ | HTR2A | P28223 | 2/20 | 0.56 |
| ▸ | HTR5A | P47898 | 2/20 | 0.56 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.56 |
| ▸ | HTR3B | O95264 | 2/20 | 0.56 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.56 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.56 |
| ▸ | NCF1 | P14598 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL5785574 | 0.98 | ADRB1 (1.00) | ADRB1DRD2DRD3HTR1AHTR3A | |
| SCHEMBL29446047 | 0.98 | ADRB1 (1.00) | ADRB1DRD2DRD3HTR1AHTR3A | |
| SCHEMBL230424 | 0.98 | ADRB1 (1.00) | ADRB1DRD2DRD3HTR1AHTR3A | |
| Bromide SCHEMBL27666738 | 0.96 | ADRB1 (0.96) | ADRB1DRD2DRD3HTR1AHTR3A | |
| Hydrochloric Acid SCHEMBL184663 | 0.96 | ADRB1 (0.96) | ADRB1DRD2DRD3HTR1AHTR3A | |
| Hydrochloric Acid SCHEMBL6577765 | 0.96 | ADRB1 (0.96) | ADRB1DRD2DRD3HTR1AHTR3A | |
| Hydrochloric Acid SCHEMBL29777392 | 0.96 | ADRB1 (0.96) | ADRB1DRD2DRD3HTR1AHTR3A | |
| Water SCHEMBL27802433 | 0.96 | ADRB1 (0.96) | ADRB1DRD2DRD3HTR1AHTR3A | |
| Hydrochloric Acid SCHEMBL2265022 | 0.94 | ADRB1 (0.92) | ADRB1DRD2DRD3HTR1AHTR3A | |
| SCHEMBL3612685 | 0.90 | ADRB1 (0.85) | ADRB1DRD2DRD3HTR1AHTR3A |
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 |
|---|---|---|---|---|---|---|---|
| CN-106699690-B | A kind of pleuromutilin derivative and its preparation method and application with acyl piperazine base side chain | 华南农业大学 | 2019-09-10 | — | — | CN | disclosed |
| CN-106699690-A | Pleuromulin derivative with acyl piperazine side chain and preparing method and application of pleuromulin derivative | 华南农业大学 | 2017-05-24 | — | — | CN | disclosed |