Propylene Glycol

Propylene Glycol

SCHEMBL11798142

CC(O)CO.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O

nearest known ligand 0.67

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Known targets — ChEMBL curated mechanism

SLC5A2

The experimentally established mechanism targets of Propylene Glycol. 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
TDP1 Q9NUW8 2/20 0.67
TSHR P16473 3/20 0.41
CA5A P35218 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
TP53 P04637 2/20 0.38
ALDH1A1 P00352 4/20 0.37
LMNA P02545 4/20 0.33
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
APEX1 P27695 1/20 0.32
BLM P54132 1/20 0.32
OR51E2 Q9H255 1/20 0.32
AKR1B1 P15121 1/20 0.32
KDM4E B2RXH2 1/20 0.31
GMNN O75496 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
PMP22 Q01453 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
Propylene Glycol SCHEMBL443703 1.00 TDP1 (0.67) TDP1TSHRCA5ACA5BTP53
Propylene Glycol SCHEMBL3441580 1.00 TDP1 (0.67) TDP1TSHRCA5ACA5BTP53
Propylene Glycol SCHEMBL575555 0.90 TDP1 (0.62) TDP1TSHRTP53ALDH1A1LMNA
Propylene Glycol SCHEMBL575982 0.88 TDP1 (0.59) TDP1TSHRTP53ALDH1A1LMNA
Propylene Glycol SCHEMBL28589912 0.85 TDP1 (0.56) TDP1TSHRTP53ALDH1A1GRIA1
Propylene Glycol SCHEMBL576545 0.83 TDP1 (0.53) TDP1TSHRTP53ALDH1A1
Propylene Glycol SCHEMBL577012 0.83 TDP1 (0.53) TDP1TSHRTP53ALDH1A1
Isobutanol SCHEMBL11251204 0.83 TSHR (0.64) TDP1TSHRCA5ACA5BTP53
Trolamine SCHEMBL23494826 0.83 TDP1 (0.46) TDP1KDM4EMAPT
Propylene Glycol SCHEMBL28578 0.82

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-3936375-A Process for dewatering a proteinaceous, aqueous sludge and for removing and recovering precipitating agents from a precipitate containing proteinaceous substances A/S APOTHEKERNES LABORATORIUM FOR SPECIALPRAEPARATER (NO) 1976-02-03 US disclosed