Propane

Propane

SCHEMBL27693170

CCC.[Au].c1ccc(Pc2ccccc2)cc1

nearest known ligand 0.41

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.41
PSIP1 O75475 1/20 0.35
LMNA P02545 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
GLA P06280 1/20 0.33
CA3 P07451 1/20 0.33
CA4 P22748 1/20 0.33
CA9 Q16790 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CA14 Q9ULX7 1/20 0.33
TSHR P16473 1/20 0.33
ALOX12 P18054 1/20 0.33
ACHE P22303 1/20 0.33
PCSK9 Q8NBP7 1/20 0.33
ATM Q13315 1/20 0.32
KCNN4 O15554 1/20 0.32
CALM1 P0DP23 1/20 0.32
ESR1 P03372 2/20 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
Propane SCHEMBL1423596 0.97 TP53 (0.43) TP53PSIP1LMNACA12CA1
Propane SCHEMBL372201 0.97 TP53 (0.43) TP53PSIP1LMNACA12CA1
Propane SCHEMBL27484901 0.94 TP53 (0.41) TP53PSIP1LMNACA12CA1
Propane SCHEMBL28226117 0.94 TP53 (0.41) TP53PSIP1LMNACA12CA1
Propane SCHEMBL5024454 0.94 TP53 (0.41) TP53PSIP1LMNACA12CA1
Propane SCHEMBL797742 0.92 TP53 (0.39) TP53PSIP1LMNACA12CA1
Propane SCHEMBL18188066 0.92 TP53 (0.39) TP53PSIP1LMNACA12CA1
Butane SCHEMBL2218261 0.88 TP53 (0.41) TP53PSIP1LMNACA12CA1
Butane SCHEMBL3883260 0.88 TP53 (0.41) TP53PSIP1LMNACA12CA1
Propane SCHEMBL3691305 0.87 TP53 (0.36) TP53PSIP1LMNAPCSK9

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
CN-101039683-A Compositions and methods using hyaluronic acid and hyaluronidase inhibitors ANGIOTECH INT AG (CH) 2007-09-19 CN disclosed