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 | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.33 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL374206 | 0.92 | HRH3 (0.54) | HRH3SMN1; SMN2HPGDKMT2AMEN1 | |
| Ammonia Solution, Strong SCHEMBL28219724 | 0.90 | HRH3 (0.53) | HRH3SMN1; SMN2HPGDKMT2AMEN1 | |
| SCHEMBL8483423 | 0.82 | HRH3 (0.49) | HRH3SMN1; SMN2HPGDKMT2AMEN1 | |
| Piperazine SCHEMBL28277014 | 0.82 | HRH3 (0.38) | HRH3HPGDKMT2AMEN1ALDH1A1 | |
| SCHEMBL222318 | 0.81 | HRH3 (0.48) | HRH3SMN1; SMN2HPGDKMT2AMEN1 | |
| SCHEMBL183835 | 0.81 | HRH3 (0.48) | HRH3SMN1; SMN2HPGDKMT2AMEN1 | |
| SCHEMBL1852285 | 0.81 | HRH3 (0.48) | HRH3SMN1; SMN2HPGDKMT2AMEN1 | |
| SCHEMBL39955 | 0.81 | TSHR (0.46) | HRH3HPGDKMT2AMEN1ALDH1A1 | |
| SCHEMBL31334735 | 0.81 | HRH3 (0.48) | HRH3SMN1; SMN2HPGDKMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL8483335 | 0.81 | HRH3 (0.48) | HRH3SMN1; SMN2HPGDKMT2AMEN1 |
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-109438513-A | IDO1 inhibitor, preparation method and application containing substituted phosphonic amide ester | 中国药科大学 | 2019-03-08 | — | — | CN | disclosed |