Piperidine

Piperidine

SCHEMBL28047155

C1CCNCC1.CC(=O)O.CCC(=O)O.CCC(=O)O

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Piperidine. 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 3/20 0.50
ALDH1A1 P00352 2/20 0.45
TDP1 Q9NUW8 1/20 0.36
LCK P06239 1/20 0.35
FYN P06241 1/20 0.35
CA2 P00918 1/20 0.33
CHKA P35790 1/20 0.33
KMT2A Q03164 1/20 0.33
SLC6A1 P30531 4/20 0.32
SLC6A11 P48066 3/20 0.32
SLC6A13 Q9NSD5 3/20 0.32
TSHR P16473 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 2/20 0.32
GABRA5 P31644 3/20 0.32
GABRB2 P47870 3/20 0.32
GABRA1 P14867 2/20 0.32
GABRA4 P48169 2/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 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.

Compoundsimilaritytop predictedshared targets
Pyrrolidine SCHEMBL10413119 0.95 FFAR3 (0.56) FFAR3ALDH1A1TDP1CA2CHKA
Pyrrolidine SCHEMBL28213560 0.95 FFAR3 (0.56) FFAR3ALDH1A1TDP1CA2CHKA
Piperidine SCHEMBL6861563 0.95 FFAR3 (0.56) FFAR3ALDH1A1TDP1CA2CHKA
Piperidine SCHEMBL1274941 0.95 FFAR3 (0.56) FFAR3ALDH1A1TDP1CA2CHKA
Piperidine SCHEMBL4661791 0.90 ALDH1A1 (0.45) FFAR3ALDH1A1TDP1LCKFYN
Piperazine SCHEMBL28047208 0.90 FFAR3 (0.56) FFAR3ALDH1A1TDP1LCKFYN
Piperidine SCHEMBL192668 0.89 ALDH1A1 (0.56) FFAR3ALDH1A1LCKFYNCA2
Piperidine SCHEMBL29043025 0.89 ALDH1A1 (0.56) FFAR3ALDH1A1LCKFYNCA2
Piperidine SCHEMBL10332243 0.89 ALDH1A1 (0.56) FFAR3ALDH1A1LCKFYNCA2
Propionic Acid SCHEMBL9615008 0.87 FFAR3 (0.59) FFAR3ALDH1A1TDP1CA2CHKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105338976-B Antimicrobial polyamide composition and mastitis treatment 梅里亚股份有限公司 2018-12-04 CN disclosed
CN-105338976-A Antimicrobial polyamide composition and mastitis treatment MERIAL INC 2016-02-17 CN disclosed