Morpholine

Morpholine

SCHEMBL28987277

C1COCCN1.CCO.[BaH2]

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Morpholine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
KDM4E B2RXH2 1/20 0.58
GAA P10253 1/20 0.58
CYP2C9 P11712 1/20 0.58
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.31
APEX1 P27695 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.

Compoundsimilaritytop predictedshared targets
Morpholine SCHEMBL1121824 0.97
Morpholine SCHEMBL28279707 0.97 MEN1 (0.61) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL27723090 0.94 MEN1 (0.58) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL28078522 0.94 MEN1 (0.58) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL11143962 0.94 MEN1 (0.67) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL27588949 0.86 KDM4E (0.55) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL10949531 0.85 MEN1 (0.48) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL8521651 0.85 MEN1 (0.48) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL456806 0.85
Morpholine SCHEMBL11338140 0.82 MEN1 (0.65) MEN1KMT2AKDM4EGAACYP2C9

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-116003660-A Linear poly-1, 3-pentadiene elastomer with high trans-1, 4-structure content and preparation method and application thereof 中国石油化工股份有限公司 2023-04-25 CN disclosed
CN-116003712-A Star-shaped poly-1, 3-pentadiene elastomer with high trans-1, 4-structure content, preparation method and application thereof 中国石油化工股份有限公司 2023-04-25 CN disclosed