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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | PDE4A | P27815 | 1/20 | 0.30 |
| ▸ | KDR | P35968 | 1/20 | 0.30 |
| ▸ | DAO | P14920 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Cyclohexane SCHEMBL9980447 | 0.84 | AURKA (0.42) | AURKAAURKBINCENPDAOHDAC8 | |
| SCHEMBL19838559 | 0.84 | — | — | |
| Fluoride SCHEMBL28006656 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL5652646 | 0.84 | — | — | |
| Ammonia Solution, Strong SCHEMBL29014480 | 0.84 | — | — | |
| SCHEMBL27969159 | 0.84 | — | — | |
| Benzene SCHEMBL28086885 | 0.84 | AURKA (0.46) | AURKAAURKBINCENPMAPTDAO | |
| Hydrochloric Acid SCHEMBL29144528 | 0.84 | — | — | |
| Oxirane SCHEMBL28467741 | 0.80 | — | — | |
| Pyrrole SCHEMBL27278443 | 0.77 | AURKA (0.41) | AURKAAURKBINCENPDAOHDAC8 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106478631-B | The preparation method of long-acting dipeptidyl peptidase-iv inhibitor, purposes and its intermediate | 四川科伦药物研究院有限公司 | 2019-04-05 | — | — | CN | disclosed |
| CN-109485916-A | A kind of synthesis and application of Aminopyrazine based flame retardant | 武汉工程大学 | 2019-03-19 | — | — | CN | disclosed |
| CN-107567445-A | It can be used as 2 phenyl 3H imidazos [4,5 B] pyridine derivates of mammal EGFR-TK ROR1 activities inhibitor | 坎塞拉有限公司 | 2018-01-09 | — | — | CN | disclosed |
| CN-104619805-B | Antistatic release agent and antistatic release film | 信越聚合物株式会社 | 2016-11-09 | — | — | CN | disclosed |