Diethanolamine

Diethanolamine

SCHEMBL27730759

CC(C)O.CC(C)O.OCCNCCO.[Ti]

nearest known ligand 0.38

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 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
LMNA P02545 2/20 0.38
TDP1 Q9NUW8 1/20 0.37
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 4/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
TP53 P04637 1/20 0.31
ALOX15 P16050 1/20 0.31
CYP1A2 P05177 1/20 0.31
POLB P06746 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
KDM4E B2RXH2 1/20 0.31
TOP2B Q02880 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
Diethanolamine SCHEMBL27730825 0.97 ALDH1A1 (0.40) ALDH1A1LMNATDP1MEN1USP2
Diethanolamine SCHEMBL1134213 0.97 ALDH1A1 (0.40) ALDH1A1LMNATDP1MEN1USP2
Isopropyl Alcohol SCHEMBL29874597 0.87 CA12 (0.48) ALDH1A1LMNATDP1MEN1MAPT
Diethanolamine SCHEMBL8017895 0.85 TDP1 (0.59) ALDH1A1LMNATDP1MEN1USP2
Isopropyl Alcohol SCHEMBL26112219 0.84 CA12 (0.50) ALDH1A1LMNATDP1MEN1MAPT
Diethanolamine SCHEMBL359260 0.83
Diethanolamine SCHEMBL31457586 0.83
Diethanolamine SCHEMBL29165291 0.82 TSHR (0.56) ALDH1A1LMNATDP1MEN1USP2
Diethanolamine SCHEMBL2803527 0.82 TP53 (0.52) ALDH1A1MEN1USP2MAPTKMT2A
Diethanolamine SCHEMBL27908425 0.80 TDP1 (0.38) ALDH1A1LMNATDP1MEN1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101581891-B Toner, image forming apparatus, image forming method, and process cartridge using the toner RICOH CO LTD 2012-09-26 CN disclosed
CN-101473273-B Toner and image forming method RICOH CO LTD 2012-06-27 CN disclosed
CN-101692157-A Toner, image forming apparatus, image forming method and process cartridge RICOH KK 2010-04-07 CN disclosed
CN-101581891-A Toner, image forming apparatus, image forming method, and process cartridge using the toner RICOH KK (JP) 2009-11-18 CN disclosed
CN-101473273-A Image forming apparatus, image forming method, and process cartridge RICOH KK (JP) 2009-07-01 CN disclosed
CN-101357982-A Promoter for polycondensation reaction KAO CORP (JP) 2009-02-04 CN disclosed