Piperazine

Piperazine

SCHEMBL28075211

C1CNCCN1.Cc1ccn(C)n1

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ESR1

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)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.38
RAB9A P51151 3/20 0.35
MAPT P10636 2/20 0.35
NPC1 O15118 2/20 0.35
KEAP1 Q14145 1/20 0.35
ATM Q13315 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NOS1 P29475 1/20 0.35
SOD3 P08294 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
DDB1 Q16531 2/20 0.33
CRBN Q96SW2 2/20 0.33
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
HTR2C P28335 2/20 0.32
ADRB1 P08588 2/20 0.32
ADRA1D P25100 1/20 0.31

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL75314 0.86
Hydrochloric Acid SCHEMBL27901405 0.84
SCHEMBL2551980 0.77 KMT2A (0.40) KMT2ARAB9AMAPTNPC1KEAP1
Boric Acid SCHEMBL17848604 0.77 NOS1 (0.42) KMT2ARAB9AMAPTNPC1KEAP1
Phosphoric Acid SCHEMBL7647885 0.74 RAB9A (0.42) KMT2ARAB9AMAPTNPC1KEAP1
Formamide SCHEMBL10967419 0.74 KEAP1 (0.39) KMT2ARAB9AMAPTNPC1KEAP1
SCHEMBL27487661 0.72 KMT2A (0.45) KMT2ARAB9AMAPTNPC1KEAP1
Pyridine SCHEMBL28098609 0.72 KMT2A (0.45) KMT2ARAB9AMAPTNPC1KEAP1
SCHEMBL1425947 0.72 CHRNB2 (0.41) KMT2AMAPTALDH1A1GABRA1GABRB2
SCHEMBL20292039 0.72 DDB1 (0.46) KMT2ARAB9ANPC1KEAP1SMN1; SMN2

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108138081-A Spice composition 奇华顿股份有限公司 2018-06-08 CN claimed
CN-105842377-A High performance liquid chromatography detection method for pyrazine compounds in Baijiu 贵州省产品质量监督检验院 2016-08-10 CN claimed
CN-110072510-A Fragrance and flavor material 高砂香料工业株式会社 2019-07-30 CN disclosed
CN-110072512-A Fragrance and flavor material 高砂香料工业株式会社 2019-07-30 CN disclosed
CN-109438369-A A kind of preparation method of Acipimox 鲁南制药集团股份有限公司 2019-03-08 CN disclosed
CN-109222209-A A kind of compound peppermint cigarette and preparation method thereof 广东省生物工程研究所(广州甘蔗糖业研究所) 2019-01-18 CN disclosed
CN-109077287-A A kind of potato essence base-material and potato essence 增城华栋调味品有限公司 2018-12-25 CN disclosed
CN-108753862-A A method of continuously fermented using recombination bacillus coli and prepares 5-Methylpyrazine-2-carboxylic acid 泰州市惠利生物科技有限公司 2018-11-06 CN disclosed
CN-103309182-B Electrophtography photosensor, handle box, image forming apparatus and image forming method 富士施乐株式会社 2018-10-09 CN disclosed
CN-105842377-B The high-efficiency liquid chromatography method for detecting of pyrazine compounds in a kind of white wine 贵州省产品质量监督检验院 2018-03-20 CN disclosed
CN-107797381-A Coloring composition and compound 住友化学株式会社 2018-03-13 CN disclosed
CN-105595405-B Method for promoting sensory quality of tobacco leaves by regulating and controlling content of alkaline flavor components 广西中烟工业有限责任公司 2017-05-03 CN disclosed