Propylene Glycol

Propylene Glycol

SCHEMBL9720403

CC(C)(CCC(=O)O)C(=O)O.CC(O)CO

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

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
ACACB O00763 1/20 0.44
ACACA Q13085 1/20 0.44
NAALAD2 Q9Y3Q0 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
CYP1A2 P05177 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
THRB P10828 1/20 0.38
KMT2A Q03164 1/20 0.38
ACLY P53396 1/20 0.37
GABRP O00591 2/20 0.34
GABRD O14764 2/20 0.34
GABRA1 P14867 2/20 0.34
GABRB1 P18505 2/20 0.34
GABRG2 P18507 2/20 0.34
GABRB3 P28472 2/20 0.34
GABRA5 P31644 2/20 0.34
GABRA3 P34903 2/20 0.34
GABRA2 P47869 2/20 0.34
GABRB2 P47870 2/20 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
SCHEMBL68460 0.85 NAALAD2 (0.52) ACACBACACANAALAD2TDP1CYP1A2
Hydrochloric Acid SCHEMBL7028451 0.83 NAALAD2 (0.50) ACACBACACANAALAD2TDP1CYP1A2
SCHEMBL6931571 0.83 NAALAD2 (0.50) ACACBACACANAALAD2TDP1CYP1A2
SCHEMBL6740712 0.83 NAALAD2 (0.50) ACACBACACANAALAD2TDP1CYP1A2
Ammonia Solution, Strong SCHEMBL8839919 0.83 NAALAD2 (0.50) ACACBACACANAALAD2TDP1CYP1A2
SCHEMBL8582765 0.83 NAALAD2 (0.50) ACACBACACANAALAD2TDP1CYP1A2
Dimebutic Acid SCHEMBL6380229 0.81 TDP1 (0.46) ACACBACACATDP1ALDH1A1ACLY
Water SCHEMBL4931332 0.81 NAALAD2 (0.48) ACACBACACANAALAD2TDP1CYP1A2
Succinic Acid SCHEMBL29364481 0.78 TDP1 (0.59) TDP1CYP1A2ALDH1A1GABRPGABRD
Succinic Acid SCHEMBL1134610 0.78 TDP1 (0.59) TDP1CYP1A2ALDH1A1GABRPGABRD

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-5082883-A Reduced viscosity polyblends of polyester and epoxy resins EASTMAN KODAK COMPANY (US) 1992-01-21 US disclosed