Diethanolamine

Diethanolamine

SCHEMBL11519563

C=CN.C=CN.C=CN.Cl.Cl.OCCNCCO

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PTGIRfolP

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

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPK1 P28482 1/20 0.31
TSHR P16473 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
Diethanolamine SCHEMBL1886510 0.80
Diethanolamine SCHEMBL1011320 0.80
Diethanolamine SCHEMBL28666648 0.80 ALDH1A1 (0.50) LMNAKDM4EMAPK1TSHR
Diethanolamine SCHEMBL27661740 0.79 TSHR (0.32) LMNAKDM4ETSHR
Hydrochloric Acid SCHEMBL6898883 0.78
Diethanolamine SCHEMBL11849912 0.77 SMN1; SMN2 (0.33) LMNASMN1; SMN2KDM4EMAPK1TSHR
Diethanolamine SCHEMBL5391215 0.77
Diethanolamine SCHEMBL901546 0.77
Diethanolamine SCHEMBL28826340 0.77 SMN1; SMN2 (0.33) LMNASMN1; SMN2KDM4EMAPK1TSHR
Hydrochloric Acid SCHEMBL650652 0.77 SMN1; SMN2 (0.43) LMNASMN1; SMN2KDM4EMAPK1TSHR

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-4145547-A Ureidoalkylphosphonates and their use for the flameproofing of textiles STAUFFER CHEMICAL COMPANY (US) 1979-03-20 US disclosed
US-4044006-A FLAME RESISTANCE STAUFFER CHEMICAL COMPANY (US) 1977-08-23 US disclosed