Piperazine

Piperazine

SCHEMBL28214068

C1CNCCN1.CCC(=O)O.CCC(=O)O

nearest known ligand 0.62

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
FFAR3 O14843 2/20 0.62
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
GABRA5 P31644 3/20 0.38
GABRB2 P47870 3/20 0.38
GABRA1 P14867 2/20 0.38
GABRA4 P48169 2/20 0.38
TSHR P16473 2/20 0.38
HIF1A Q16665 1/20 0.38
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38
GABRE P78334 1/20 0.38
PMP22 Q01453 1/20 0.38

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
Piperazine SCHEMBL5818604 1.00 FFAR3 (0.62) FFAR3HDAC3HDAC1HDAC2HDAC8
Propionic Acid SCHEMBL3790146 0.97
Piperazine SCHEMBL28047208 0.94 FFAR3 (0.56) FFAR3HDAC3HDAC1HDAC2HDAC8
Propionic Acid SCHEMBL29104606 0.94
Piperidine SCHEMBL6861563 0.88 FFAR3 (0.56) FFAR3HDAC3HDAC1HDAC2HDAC8
Pyrrolidine SCHEMBL28213560 0.88 FFAR3 (0.56) FFAR3HDAC3HDAC1HDAC2HDAC8
Propionic Acid SCHEMBL28087121 0.88 FFAR3 (0.56) FFAR3HDAC3HDAC1HDAC2HDAC8
Piperidine SCHEMBL1274941 0.88 FFAR3 (0.56) FFAR3HDAC3HDAC1HDAC2HDAC8
Pyrrolidine SCHEMBL10413119 0.88 FFAR3 (0.56) FFAR3HDAC3HDAC1HDAC2HDAC8
Propionic Acid SCHEMBL9615008 0.85 FFAR3 (0.59) FFAR3HDAC3HDAC1HDAC2HDAC8

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105189607-B Amine-functional polyamides 建新公司 2018-06-15 CN disclosed