Ethylene Glycol

Ethylene Glycol

SCHEMBL28530734

C=CC[C@@]1(C(=O)O)CCCN1.OCCO

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 1/20 0.45
ARG2 P78540 1/20 0.45
PARP1 P09874 1/20 0.32
CYP2D6 P10635 2/20 0.30
SLC6A2 P23975 2/20 0.30
SLC6A4 P31645 2/20 0.30
SLC6A3 Q01959 2/20 0.30
KCNH2 Q12809 1/20 0.30

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
SCHEMBL1360119 0.95 ARG1 (0.49) ARG1ARG2PARP1CYP2D6SLC6A2
SCHEMBL1360118 0.95 ARG1 (0.49) ARG1ARG2PARP1CYP2D6SLC6A2
Hydrochloric Acid SCHEMBL30382824 0.93 ARG1 (0.47) ARG1ARG2PARP1CYP2D6SLC6A2
Hydrochloric Acid SCHEMBL4684924 0.93 ARG1 (0.47) ARG1ARG2PARP1CYP2D6SLC6A2
SCHEMBL21645480 0.88 ARG1 (0.43) ARG1ARG2PARP1
SCHEMBL28516379 0.79 ARG1 (0.37) ARG1ARG2
SCHEMBL14265250 0.78 ARG1 (0.54) ARG1ARG2CYP2D6SLC6A2SLC6A4
SCHEMBL12764363 0.77 ARG1 (0.36) ARG1ARG2PARP1CYP2D6SLC6A2
SCHEMBL8190743 0.77 ARG1 (0.36) ARG1ARG2PARP1CYP2D6SLC6A2
SCHEMBL3676543 0.76 ARG1 (0.54) ARG1ARG2CYP2D6SLC6A2SLC6A4

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
CN-112423774-A Therapeutic compositions and methods of use for treating mild cognitive impairment, depression and psychological disorders L·H·L·特兰 2021-02-26 CN claimed
CN-112423774-A Therapeutic compositions and methods of use for treating mild cognitive impairment, depression and psychological disorders L·H·L·特兰 2021-02-26 CN disclosed