Morpholine

Morpholine

SCHEMBL9434759

C1COCCN1.O=S(=O)([O-])O.[H+]

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CYP51cyp51Acyp51c

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 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
KDM4E B2RXH2 1/20 0.52
GAA P10253 1/20 0.52
CYP2C9 P11712 1/20 0.52
TSHR P16473 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRG2 P18507 1/20 0.36
NFKB1 P19838 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
GABRA2 P47869 1/20 0.36
GABRA6 Q16445 1/20 0.36
HTR2C P28335 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
Morpholine SCHEMBL6686007 0.88 MEN1 (0.41) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL2808233 0.87 MEN1 (0.61) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL2808231 0.87 MEN1 (0.61) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL28072685 0.87 MEN1 (0.61) MEN1KMT2AKDM4EGAACYP2C9
Sulfuric Acid SCHEMBL8024423 0.84 KDM4E (0.67) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL15789448 0.84 MEN1 (0.58) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL15789446 0.84 MEN1 (0.58) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL10346421 0.82 MEN1 (0.55) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL10346420 0.82 MEN1 (0.55) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL9393876 0.82 MEN1 (0.55) 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
US-5278293-A Aromatic amide-alkylenesulfonic acid fiber-reactive dyes BAYER AKTIENGESELLSCHAFT (DE) 1994-01-11 US disclosed
US-5132410-A Dyeing cellulose BAYER AKTIENGESELLSCHAFT (DE) 1992-07-21 US disclosed