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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | NCF1 | P14598 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.39 |
| ▸ | HTR3B | O95264 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.39 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.39 |
| ▸ | PLD1 | Q13393 | 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 | |
|---|---|---|---|---|
| SCHEMBL88611 | 0.86 | ALDH1A1 (0.55) | ALDH1A1CYP3A4TSHRNFKB1THPO | |
| SCHEMBL29358342 | 0.86 | ALDH1A1 (0.55) | ALDH1A1CYP3A4TSHRNFKB1THPO | |
| SCHEMBL29408294 | 0.86 | ALDH1A1 (0.55) | ALDH1A1CYP3A4TSHRNFKB1THPO | |
| Ethyne SCHEMBL27784530 | 0.81 | ALDH1A1 (0.50) | ALDH1A1CYP3A4TSHRNFKB1THPO | |
| Quinoxaline SCHEMBL1138249 | 0.81 | NCF1 (0.48) | ALDH1A1CYP3A4TSHRNFKB1THPO | |
| Quinoline SCHEMBL27309468 | 0.78 | ALDH1A1 (0.74) | ALDH1A1CYP3A4TSHRNFKB1THPO | |
| Quinoline SCHEMBL3629028 | 0.78 | ALDH1A1 (0.74) | ALDH1A1CYP3A4TSHRNFKB1THPO | |
| Piperazine SCHEMBL28857921 | 0.77 | HTR2C (0.46) | ALDH1A1CYP3A4TSHRNFKB1THPO | |
| Quinoline SCHEMBL28274774 | 0.77 | ALDH1A1 (0.71) | ALDH1A1CYP3A4TSHRNFKB1THPO | |
| Quinoline SCHEMBL28192494 | 0.77 | ALDH1A1 (0.71) | ALDH1A1CYP3A4TSHRNFKB1THPO |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103384672-B | The substituted piperazine of N-pteridine and piperazine pteridinone | 武田药品工业株式会社 | 2016-09-28 | — | — | CN | disclosed |