Tromethamine

Tromethamine

SCHEMBL5014094

CCC(C)c1cc(C(C)CC)c(OP(O)O)c(C(C)CC)c1.NC(CO)(CO)CO

nearest known ligand 0.34

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 9)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.34
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
PKM P14618 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
PPARA Q07869 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
SCHEMBL5014097 0.75 PPARA (0.35) RORCUSP2ALDH1A1GAAPKM
SCHEMBL29402818 0.69 PPARA (0.38) RORCUSP2ALDH1A1GAAPKM
SCHEMBL29742688 0.69 RORC (0.31) RORC
SCHEMBL1836944 0.68 TSHR (0.48) RORCUSP2ALDH1A1GAAPKM
SCHEMBL5915809 0.65 GABRA1 (0.42) RORCUSP2ALDH1A1GAAPKM
SCHEMBL30028519 0.64 ALDH1A1 (0.35) RORCUSP2ALDH1A1GAAPKM
SCHEMBL15065156 0.63 TSHR (0.44) RORCUSP2ALDH1A1GAAPKM
SCHEMBL6744605 0.63 TSHR (0.44) RORCUSP2ALDH1A1GAAPKM
SCHEMBL2173625 0.63 TSHR (0.48) RORCUSP2ALDH1A1GAAPKM
Tromethamine SCHEMBL4624515 0.63 CA2 (0.37) ALDH1A1

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-1289041-B1 Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL CO (JP) 2008-03-12 EP disclosed