Monoethanolamine

Monoethanolamine

SCHEMBL6139326

CCCCCCCCCCCCCCCCC(=O)C(=O)NCCCCCCCCCCCCCC.NCCO

nearest known ligand 0.71

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MPL

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

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.71
PLA2G4A P47712 1/20 0.66
NAAA Q02083 1/20 0.54
SLC6A5 Q9Y345 2/20 0.50
GNAI3 P08754 1/20 0.49
GNAO1 P09471 1/20 0.49
GNAI1 P63096 1/20 0.49
CASP2 P42575 1/20 0.49
EPHX1 P07099 5/20 0.48
CES2 O00748 3/20 0.48
CES1 P23141 3/20 0.48
RRM1 P23921 1/20 0.47
EPHX2 P34913 1/20 0.45

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
Monoethanolamine SCHEMBL6138913 1.00 PLA2G2A (0.71) PLA2G2APLA2G4ANAAASLC6A5GNAI3
SCHEMBL10062565 0.86 PLA2G2A (0.71) PLA2G2APLA2G4ANAAACES2CES1
SCHEMBL12636328 0.86 PLA2G2A (0.79) PLA2G2APLA2G4ANAAACASP2EPHX1
Monoethanolamine SCHEMBL6139295 0.83 NAAA (0.73) NAAASLC6A5CASP2EPHX2
SCHEMBL28776220 0.83 PLA2G2A (1.00) PLA2G2APLA2G4AEPHX2
Monoethanolamine SCHEMBL28044583 0.83 NAAA (0.73) NAAASLC6A5CASP2EPHX2
Monoethanolamine SCHEMBL6139219 0.83 NAAA (0.73) NAAASLC6A5CASP2EPHX2
SCHEMBL29449856 0.81 PLA2G4A (0.73) PLA2G2APLA2G4ANAAACASP2EPHX1
SCHEMBL30439276 0.81 PLA2G2A (0.67) PLA2G2APLA2G4ANAAACASP2EPHX1
SCHEMBL1877382 0.79 PLA2G4A (1.00) PLA2G2APLA2G4AEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1370241-B1 MULTI-LAMELLAR EMULSION(MLE) FOR STABILIZING DERMATOLOGICALLY USEFUL INGREDIENTS AND EXTERNAL BASE PREPARATIONS FOR GENERAL SKIN DISEASES UTILIZING THE SAME NEOPHARM CO LTD (KR) 2012-11-21 EP disclosed
EP-1370241-A4 MULTI-LAMELLAR EMULSION(MLE) FOR STABILIZING DERMATOLOGICALLY USEFUL INGREDIENTS AND EXTERNAL BASE PREPARATIONS FOR GENERAL SKIN DISEASES UTILIZING THE SAME NEOPHARM CO LTD (KR) 2005-01-26 EP disclosed
EP-1370241-A1 MULTI-LAMELLAR EMULSION(MLE) FOR STABILIZING DERMATOLOGICALLY USEFUL INGREDIENTS AND EXTERNAL BASE PREPARATIONS FOR GENERAL SKIN DISEASES UTILIZING THE SAME Neopharm Co., Ltd. (KR) 2003-12-17 EP disclosed
WO-2002067900-A1 MULTI-LAMELLAR EMULSION(MLE) FOR STABILIZING DERMATOLOGICALLY USEFUL INGREDIENTS AND EXTERNAL BASE PREPARATIONS FOR GENERAL SKIN DISEASES UTILIZING THE SAME NEOPHARM CO., LTD. (KR) 2002-09-06 WO disclosed