Propane

Propane

SCHEMBL9755034

CCC.O=C(O)[C@@H]1CCN1

nearest known ligand 0.56

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
CYP1A2 P05177 1/20 0.48
THRB P10828 1/20 0.48
ALOX15 P16050 1/20 0.48
CYP2C19 P33261 1/20 0.48
KMT2A Q03164 1/20 0.48
GRIN2D O15399 1/20 0.48
GRIN3B O60391 1/20 0.48
GRIA1 P42261 1/20 0.48
GRIA2 P42262 1/20 0.48
GRIA3 P42263 1/20 0.48
GRIA4 P48058 1/20 0.48
GRIN1 Q05586 1/20 0.48
GRIN2A Q12879 1/20 0.48
GRIN2B Q13224 1/20 0.48
GRIN2C Q14957 1/20 0.48
GRIN3A Q8TCU5 1/20 0.48
ARG1 P05089 1/20 0.47
PRCP P42785 1/20 0.44

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
SCHEMBL1527305 0.89
SCHEMBL20296 0.89
SCHEMBL122166 0.89
Acetic Acid SCHEMBL4726910 0.87 MEN1 (0.46) MEN1ALDH1A1CYP1A2THRBALOX15
Ammonia Solution, Strong SCHEMBL31008744 0.87
Hydrochloric Acid SCHEMBL3623568 0.87
Hydrochloric Acid SCHEMBL3540925 0.87
SCHEMBL17743461 0.87
Methane SCHEMBL27771786 0.87
Hydrochloric Acid SCHEMBL3540927 0.87

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
WO-1991013091-A1 CRYOPERSERVATION OF RED BLOOD CELLS AGOURON PHARMACEUTICALS, INC. (US) 1991-09-05 WO disclosed