Tromethamine

Tromethamine

SCHEMBL7206970

NC(CO)(CO)CO.O=P(O)(O)OCC(Br)CBr

nearest known ligand 0.38

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 13)

geneUniProtsupporting neighboursconfidence
PGD P52209 3/20 0.37
PGK1 P00558 1/20 0.36
PGK2 P07205 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
S1PR1 P21453 9/20 0.35
S1PR3 Q99500 9/20 0.35
MPI P34949 1/20 0.34
S1PR4 O95977 3/20 0.33
S1PR5 Q9H228 3/20 0.33
S1PR2 O95136 2/20 0.33
ALDH1A1 P00352 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
SCHEMBL2239094 0.87 PGK1 (0.45) PGDPGK1PGK2MPIALDH1A1
Tromethamine SCHEMBL11584584 0.86 PGD (0.35) PGDPGK1PGK2MEN1LMNA
SCHEMBL11601014 0.85 PGK1 (0.43) PGDPGK1PGK2MPIALDH1A1
Ammonia Solution, Strong SCHEMBL11700135 0.85 PGK1 (0.43) PGDPGK1PGK2MPIALDH1A1
Ammonia Solution, Strong SCHEMBL11596350 0.85 PGK1 (0.43) PGDPGK1PGK2MPIALDH1A1
Isopropylamine SCHEMBL11597104 0.81 PGD (0.39) PGDPGK1PGK2S1PR1S1PR3
Isopropylamine SCHEMBL11597106 0.81 PGD (0.39) PGDPGK1PGK2S1PR1S1PR3
Tromethamine SCHEMBL6755601 0.79 PGD (0.35) PGDPGK1PGK2MEN1LMNA
Tromethamine SCHEMBL3421353 0.76 MEN1 (0.40) MEN1LMNAKMT2AS1PR1S1PR3
Tromethamine SCHEMBL1843995 0.75 S1PR1 (0.40) PGDPGK1PGK2MEN1LMNA

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3497155-A1 METHOD FOR PRODUCING EXPANDED GRANULAR MATERIAL BASF SE (DE) 2019-06-19 EP disclosed
EP-0927231-B1 LOW DENSITY, LIGHT WEIGHT INTUMESCENT COATING AKZO NOBEL NV (NL) 2003-11-26 EP disclosed
US-6096812-A EPOXY-BASED INTUMESCENT FIRE RESISTIVE COATING HAVING MINUTE PARTICLES OF AMORPHOUS SILICA DISPERSED THEREIN TEXTRON SYSTEMS CORPORATION (US) 2000-08-01 US disclosed
US-4297138-A USEFUL AS FLAME RETARDANTS STAUFFER CHEMICAL COMPANY (US) 1981-10-27 US disclosed
US-4225522-A FIRE RETARDANTS STAUFFER CHEMICAL COMPANY (US) 1980-09-30 US disclosed
US-4086303-A FIRE RETARDANTS STAUFFER CHEMICAL COMPANY (US) 1978-04-25 US disclosed
US-4080491-A CATALYST CONTAINS ORGANOMETALLIC COMPOUND AND THE REACTION PRODUCT OF TUNGSTEN OR MOLYBDENUM OXIDE AND A PHOSPHOROUS HALIDE OR OXYHALIDE SHOWA DENKO K.K. (JA) 1978-03-21 US disclosed