Trolamine

Trolamine

SCHEMBL17599677

CC(O)CO.CCCCCCCCCCCCOCCCCCCCCCCCC.O=S(=O)(O)O.OCCN(CCO)CCO

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC5A2

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ USP2 O75604 1/20 0.45
▸ SPHK1 Q9NYA1 1/20 0.44
▸ TSHR P16473 1/20 0.38
▸ CES2 O00748 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ PLA2G2C Q5R387 1/20 0.36
▸ LPAR5 Q9H1C0 1/20 0.36
▸ CA1 P00915 5/20 0.34
▸ CA2 P00918 5/20 0.34
▸ CA9 Q16790 5/20 0.34
▸ CA12 O43570 1/20 0.34
▸ CA3 P07451 1/20 0.34
▸ CA4 P22748 1/20 0.34
▸ CA6 P23280 1/20 0.34
▸ CA5A P35218 1/20 0.34

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
Trolamine SCHEMBL497343 0.91 MEN1 (0.55) HTTMEN1THRBKMT2AMAPT
Trolamine SCHEMBL10924191 0.91 MEN1 (0.55) HTTMEN1THRBKMT2AMAPT
Trolamine SCHEMBL28958108 0.91 MEN1 (0.55) HTTMEN1THRBKMT2AMAPT
Sulfuric Acid SCHEMBL9773608 0.88 MEN1 (0.52) HTTMEN1THRBKMT2AMAPT
Sulfuric Acid SCHEMBL10924188 0.88 MEN1 (0.52) HTTMEN1THRBKMT2AMAPT
Trolamine SCHEMBL5962250 0.88 MEN1 (0.52) HTTMEN1THRBKMT2AMAPT
Sulfuric Acid SCHEMBL1490955 0.88 MEN1 (0.52) HTTMEN1THRBKMT2AMAPT
Trolamine SCHEMBL17599676 0.85 USP2 (0.37) HTTMEN1THRBKMT2AMAPT
Trolamine SCHEMBL27497348 0.82 MEN1 (0.65) HTTMEN1THRBKMT2AMAPT
Trolamine SCHEMBL3690709 0.82 MEN1 (0.65) HTTMEN1THRBKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2632427-B1 OPHTHALMIC COMPOSITIONS CONTAINING PROSTAGLANDINS OMNIVISION GMBH (DE) 2016-03-23 — — EP disclosed
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