Cyanide

Cyanide

SCHEMBL30213102

C#N.CCCCCCCCCCN1CCCCC1CCC

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 3/20 0.58
S1PR3 Q99500 3/20 0.58
S1PR5 Q9H228 3/20 0.58
S1PR4 O95977 1/20 0.57
SPHK2 Q9NRA0 3/20 0.42
SPHK1 Q9NYA1 3/20 0.42
CHRNB2 P17787 1/20 0.39
CHRNA7 P36544 1/20 0.39
CHRNA4 P43681 1/20 0.39
OPRD1 P41143 1/20 0.39
GBA1 P04062 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
HSD17B10 Q99714 2/20 0.37
ALOX15 P16050 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
GNAI3 P08754 2/20 0.37
GNAO1 P09471 2/20 0.37
GNAI1 P63096 2/20 0.37
TSHR P16473 1/20 0.36
RECQL P46063 1/20 0.36

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
Cyanide SCHEMBL30330627 1.00 S1PR1 (0.58) S1PR1S1PR3S1PR5S1PR4SPHK2
Cyanide SCHEMBL30330614 1.00 S1PR1 (0.58) S1PR1S1PR3S1PR5S1PR4SPHK2
Cyanide SCHEMBL30330343 0.98 S1PR1 (0.56) S1PR1S1PR3S1PR5S1PR4SPHK2
Cyanide SCHEMBL30330946 0.95 S1PR1 (0.62) S1PR1S1PR3S1PR5S1PR4SPHK2
Cyanide SCHEMBL30329854 0.95 S1PR1 (0.62) S1PR1S1PR3S1PR5S1PR4SPHK2
Cyanide SCHEMBL30330112 0.95 S1PR1 (0.62) S1PR1S1PR3S1PR5S1PR4SPHK2
Cyanide SCHEMBL30330549 0.95 S1PR1 (0.62) S1PR1S1PR3S1PR5S1PR4SPHK2
Cyanide SCHEMBL30330705 0.95 S1PR1 (0.62) S1PR1S1PR3S1PR5S1PR4SPHK2
Cyanide SCHEMBL30330726 0.93 S1PR1 (0.54) S1PR1S1PR3S1PR5S1PR4SPHK2
Cyanide SCHEMBL30330964 0.93 S1PR1 (0.60) S1PR1S1PR3S1PR5S1PR4SPHK2

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
EP-4155723-A1 ELECTROCHEMICAL GAS SENSOR AND ELECTROLYTE FOR AN ELECTROCHEMICAL GAS SENSOR Dräger Safety AG & Co. KGaA (DE) 2023-03-29 EP disclosed