SCHEMBL5044801

SCHEMBL5044801

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nearest known ligand 0.32

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 4/20 0.32
CHRM3 P20309 4/20 0.32
CHRM2 P08172 3/20 0.32
CHRM4 P08173 3/20 0.32
CHRM5 P08912 3/20 0.32
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 1/20 0.30
AKR1A1 P14550 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
ADRA1A P35348 1/20 0.30
HRH1 P35367 1/20 0.30
DRD3 P35462 1/20 0.30
SLC6A3 Q01959 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL468810 0.82 OR51E2 (0.35) CHRM1CHRM3CHRM2CHRM4CHRM5
SCHEMBL468809 0.82 OR51E2 (0.35) CHRM1CHRM3CHRM2CHRM4CHRM5
SCHEMBL12436617 0.82 OR51E2 (0.35) CHRM1CHRM3CHRM2CHRM4CHRM5
SCHEMBL27390678 0.81 FOLH1 (0.36) CHRM1CHRM3CHRM2CHRM4CHRM5
SCHEMBL16666078 0.81 FOLH1 (0.45)
SCHEMBL21621641 0.79 CHRNB2 (0.36) CHRM1CHRM3CHRNB2CHRNB4CHRNA3
SCHEMBL6562047 0.79 CHRNB2 (0.36) CHRM1CHRM3CHRNB2CHRNB4CHRNA3
SCHEMBL9781788 0.78 RNPEP (0.52)
SCHEMBL9781791 0.78 RNPEP (0.52)
SCHEMBL14195450 0.77 CHRM1 (0.33) CHRM1CHRM3CHRM2CHRM4CHRM5

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
EP-1907558-A2 USE OF DIMETHYL DISULFIDE FOR METHIONINE PRODUCTION IN MICROORGANISMS BASF SE (DE) 2008-04-09 EP disclosed
WO-2007011939-A2 USE OF DIMETHYL DISULFIDE FOR METHIONINE PRODUCTION IN MICROORGANISMS BASF AG (DE) 2007-01-25 WO disclosed