Monoethanolamine

SCHEMBL7958985

CCC(CC)CCC(C)C(C(=O)O)(C(C)CCC(CC)CC)C(C(=O)O)S(=O)(=O)O.NCCO.NCCO.NCCO

nearest known ligand 0.30

Known targets — ChEMBL curated mechanism

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 1)

	gene	UniProt	supporting neighbours	confidence
▸	GABRR1	P24046	2/20	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.

Compound	similarity	top predicted	shared targets
Monoethanolamine SCHEMBL7095004	0.92	RECQL (0.35)	—
Ammonia Solution, Strong SCHEMBL7955239	0.90	—	—
Monoethanolamine SCHEMBL7098966	0.84	TP53 (0.40)	—
Ammonia Solution, Strong SCHEMBL7099683	0.82	RECQL (0.39)	—
Monoethanolamine SCHEMBL7094954	0.79	CHRM1 (0.36)	GABRR1
Monoethanolamine SCHEMBL7099231	0.74	GPR84 (0.36)	—
Ammonia Solution, Strong SCHEMBL7100038	0.73	TP53 (0.41)	—
SCHEMBL7102067	0.72	CYP3A4 (0.33)	—
Monoethanolamine SCHEMBL7098132	0.72	RECQL (0.37)	—
SCHEMBL796340	0.70	RNPEP (0.35)	—

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-6261352-B1	BETAINE, SULFO ESTER	THE PILOT INK CO., LTD. (JP)	2001-07-17	—	—	US	disclosed
EP-0964036-A2	Water-based ball-point pen ink composition	THE PILOT INK CO., LTD. (JP)	1999-12-15	—	—	EP	disclosed