Tromethamine

Tromethamine

SCHEMBL5990767

N#CCCP.NC(CO)(CO)CO

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

DHFRGARTPTGFRPTGIRPTGS1PTGS2TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8envmurAthyA

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

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
LMNA P02545 1/20 0.48
KMT2A Q03164 1/20 0.48
LOX P28300 1/20 0.32
LOXL3 P58215 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL297153 0.76
Tromethamine SCHEMBL11284325 0.74 MEN1 (0.46) MEN1LMNAKMT2ALOXLOXL3
Hydrochloric Acid SCHEMBL28881411 0.73
Hydrochloric Acid SCHEMBL23362774 0.73
Bromide SCHEMBL11219310 0.73
Tromethamine SCHEMBL680918 0.72
Tromethamine SCHEMBL9298764 0.72
Tromethamine SCHEMBL9718986 0.71 MEN1 (0.42) MEN1LMNAKMT2A
Tromethamine SCHEMBL6143310 0.71 MEN1 (0.62) MEN1LMNAKMT2A
Tromethamine SCHEMBL2943158 0.70 MEN1 (0.71) MEN1LMNAKMT2A

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
US-7045531-B1 Composition comprising a metal chelator and a method of treating amyloidosis by administering the metal chelator THE GENERAL HOSPITAL CORPORATION (US) 2006-05-16 US disclosed