Tromethamine

Tromethamine

SCHEMBL11629948

CCCCCCCCCCCCOB(O)O.NC(CO)(CO)CO

nearest known ligand 0.40

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 19)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 7/20 0.40
TNNC1 P63316 5/20 0.40
S1PR4 O95977 5/20 0.40
S1PR3 Q99500 5/20 0.40
S1PR5 Q9H228 5/20 0.40
SGPL1 O95470 1/20 0.40
GPR183 P32249 1/20 0.40
CERS2 Q96G23 1/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
THRB P10828 1/20 0.38
HTT P42858 1/20 0.38
MAPT P10636 1/20 0.38
SPHK2 Q9NRA0 2/20 0.38
SPHK1 Q9NYA1 1/20 0.38
LMNA P02545 1/20 0.37
S1PR2 O95136 3/20 0.36
DNM1 Q05193 1/20 0.36
USP2 O75604 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
Tromethamine SCHEMBL11630782 1.00 S1PR1 (0.40) S1PR1TNNC1S1PR4S1PR3S1PR5
SCHEMBL4861420 0.84 THRB (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL5715855 0.84 THRB (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL3059895 0.84 THRB (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL4849476 0.84 THRB (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL23302194 0.84 THRB (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL2338285 0.84 THRB (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL187351 0.84 THRB (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL4190029 0.84 THRB (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL31307196 0.84 THRB (0.44) MEN1KMT2ATHRBHTTMAPT

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-4087597-A Anti-fouling compositions BIOMARINE HANDELSGESELLSCHAFT AG. (FL) 1978-05-02 US disclosed