Tromethamine

Tromethamine

SCHEMBL981329

CC(C)(C)NS(C)(=O)=O.CC(C)(C)NS(C)(=O)=O.CC(C)(C)NS(C)(=O)=O.NC(CO)(CO)CO

nearest known ligand 0.43

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 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CA2 P00918 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
Tromethamine SCHEMBL11143695 0.81 MEN1 (0.59) MEN1LMNAKMT2ACA2
SCHEMBL1046637 0.78
Hydrochloric Acid SCHEMBL4697105 0.75 MAPT (0.40) MEN1LMNAKMT2AALDH1A1MAPT
SCHEMBL1780393 0.72 KDM4E (0.38) ALDH1A1CA2
Deanol SCHEMBL1780396 0.71 LMNA (0.35) MEN1LMNAKMT2ACA2
Tromethamine SCHEMBL5988271 0.70 LMNA (0.67) MEN1LMNAKMT2ACA2
Tromethamine SCHEMBL1508805 0.70 LMNA (0.67) MEN1LMNAKMT2ACA2
Tromethamine SCHEMBL4939766 0.70 LMNA (0.67) MEN1LMNAKMT2ACA2
Tromethamine SCHEMBL2859906 0.70 MEN1 (0.50) MEN1LMNAKMT2ACA2
Tromethamine SCHEMBL7510306 0.69 MEN1 (0.77) 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-20110005038-A1 BUTTON MADE OF BIOMASS MATERIAL AND METHOD FOR PRODUCING THE SAME TEIJIN LIMITED (JP) 2011-01-13 US disclosed