Tromethamine

Tromethamine

SCHEMBL8936995

CN(C)c1ccc(S)cc1.NC(CO)(CO)CO

nearest known ligand 0.42

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 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
ALOX15 P16050 4/20 0.42
TSHR P16473 4/20 0.42
HSD17B10 Q99714 2/20 0.42
HPGD P15428 2/20 0.41
MAPT P10636 2/20 0.41
SLC2A1 P11166 1/20 0.41
CYP3A4 P08684 3/20 0.40
MAPK1 P28482 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
TP53 P04637 1/20 0.40
HBB P68871 1/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
LMNA P02545 1/20 0.39
ADRA2A P08913 3/20 0.37
ADRA2B P18089 2/20 0.37
ADRA2C P18825 2/20 0.37
GAA P10253 2/20 0.37
RAB9A P51151 2/20 0.36

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 SCHEMBL7101299 0.85 ALDH1A1 (0.42) ALDH1A1ALOX15TSHRHSD17B10HPGD
SCHEMBL543678 0.78 ALDH1A1 (0.69) ALDH1A1ALOX15TSHRHSD17B10HPGD
Tromethamine SCHEMBL5702541 0.78 LMNA (0.43) ALDH1A1TDP1KMT2AMEN1LMNA
Tromethamine SCHEMBL6477534 0.72 S1PR1 (0.44) KMT2AMEN1LMNARAB9ANPC1
Tromethamine SCHEMBL6787515 0.72 IDO1 (0.54) ALDH1A1MAPTKMT2AMEN1LMNA
Tromethamine SCHEMBL8920729 0.70 MEN1 (0.36) KMT2AMEN1LMNA
Tromethamine SCHEMBL1278460 0.69 MEN1 (0.62) KMT2AMEN1LMNA
Tromethamine SCHEMBL8772229 0.69 MEN1 (0.62) KMT2AMEN1LMNA
Tromethamine SCHEMBL1759319 0.68 MEN1 (0.71) MAPTKMT2AMEN1LMNA
Trifluoromethanesulfonic Acid SCHEMBL4575017 0.68 ALDH1A1 (0.41) ALDH1A1ALOX15TSHRHSD17B10HPGD

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-5569784-A FINE PATTERN; PREVENTS POST-EXPOSURE DELAY SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-10-29 US claimed