Trolamine

Trolamine

SCHEMBL5875419

O=C(O)/C=C/C(=O)O.OCCN(CCO)CCO.OCCN(CCO)CCO

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol

The experimentally established mechanism targets of Trolamine. 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
MEN1 known ✓ O00255 1/20 0.34
KMT2A known ✓ Q03164 1/20 0.34
CHRM2 known ✓ P08172 1/20 0.32
SLC6A2 known ✓ P23975 1/20 0.32
SLC6A4 known ✓ P31645 1/20 0.32
TSHR P16473 5/20 0.50
TP53 P04637 1/20 0.50
EGLN1 Q9GZT9 1/20 0.50
EGLN3 Q9H6Z9 1/20 0.50
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 2/20 0.39
ALOX15 P16050 2/20 0.39
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GAA P10253 2/20 0.38
NPC1 O15118 1/20 0.38
TDP1 Q9NUW8 4/20 0.36
BLM P54132 3/20 0.36
GABRR1 P24046 2/20 0.36
GABRR2 P28476 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
Trolamine SCHEMBL5874734 1.00 TSHR (0.50) TSHRTP53EGLN1EGLN3ALDH1A1
Trolamine SCHEMBL30358483 1.00 TSHR (0.50) TSHRTP53EGLN1EGLN3ALDH1A1
Trolamine SCHEMBL4944905 1.00 TSHR (0.50) TSHRTP53EGLN1EGLN3ALDH1A1
Trolamine SCHEMBL4944913 1.00 TSHR (0.50) TSHRTP53EGLN1EGLN3ALDH1A1
Trolamine SCHEMBL6479985 1.00 TSHR (0.50) TSHRTP53EGLN1EGLN3ALDH1A1
Trolamine SCHEMBL14989224 1.00 TSHR (0.50) TSHRTP53EGLN1EGLN3ALDH1A1
Trolamine SCHEMBL6838017 0.97 TSHR (0.47) TSHRTP53EGLN1EGLN3ALDH1A1
Trolamine SCHEMBL28088241 0.95 TSHR (0.45) TSHRTP53EGLN1EGLN3ALDH1A1
Trolamine SCHEMBL27950677 0.89 ALDH1A1 (0.41) TSHRTP53EGLN1EGLN3ALDH1A1
Fumaric Acid SCHEMBL1131856 0.85 ALDH1A1 (0.50) ALDH1A1HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7128976-B2 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2006-10-31 US disclosed
US-20030091838-A1 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2003-05-15 US disclosed