Cysteine

Cysteine

SCHEMBL9575898

CCCCCCCC/C=C\CCCCCCCCC[N+](O)(O)CC.CCCCCCCC/C=C\CCCCCCCCC[N+](O)(O)CC.NC(CS)C(=O)[O-].NC(CS)C(=O)[O-]

nearest known ligand 0.43

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Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 7/20 0.43
FAAH O00519 5/20 0.41
SOAT1 P35610 2/20 0.41
MEN1 O00255 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
SLC6A5 Q9Y345 1/20 0.39
KDM4E B2RXH2 2/20 0.38

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
Glycine SCHEMBL9575923 0.81 FABP3 (0.54) FABP3FAAHSOAT1MEN1TP53
Cysteine SCHEMBL9575905 0.80 FABP3 (0.41) FABP3FAAHSOAT1MEN1TP53
Glycolic Acid SCHEMBL9794793 0.79 FABP3 (0.56) FABP3FAAHCYP1A2CYP2C19KMT2A
Succinic Acid SCHEMBL9575744 0.79 FABP3 (0.65) FABP3FAAHCYP1A2CYP2C19KMT2A
SCHEMBL11287562 0.78 FAAH (0.48) FABP3FAAHSOAT1MEN1TP53
SCHEMBL9575935 0.78 FAAH (0.48) FABP3FAAHSOAT1MEN1TP53
Formic Acid SCHEMBL9794870 0.77 FAAH (0.50) FABP3FAAHSOAT1MEN1TP53
Hydrochloric Acid SCHEMBL9575644 0.77 FAAH (0.47) FABP3FAAHSOAT1MEN1TP53
Hydrochloric Acid SCHEMBL28769371 0.77 FAAH (0.47) FABP3FAAHSOAT1MEN1TP53
Glycine SCHEMBL10338990 0.76 PPARG (0.53) FABP3FAAHCYP1A2CYP3A4CYP2C19

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-0371406-B1 OXYALKYLATED QUATERNARY AMMONIUM COMPOUNDS, PROCESSES FOR PRODUCTION THEREOF, AND PLANT GROWTH REGULATING COMPOSITIONS CONTAINING SAID COMPOUNDS DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 1993-08-04 EP disclosed