Acetylcysteine

Acetylcysteine

SCHEMBL5080784

CC(=O)N1CCC(=S)[C@H]1C(=O)O.CC(=O)N[C@@H](CS)C(=O)O

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.53
KDM4E B2RXH2 1/20 0.53
MAPT P10636 1/20 0.53
THRB P10828 1/20 0.53
ALOX15 P16050 1/20 0.53
NFKB1 P19838 1/20 0.53
PTGS2 P35354 1/20 0.53
THPO P40225 1/20 0.53
RECQL P46063 1/20 0.53
BLM P54132 1/20 0.53
ACE P12821 7/20 0.36
ALDH1A1 P00352 3/20 0.35
FOLH1 Q04609 1/20 0.32
ITGB3 P05106 2/20 0.31
ITGA2B P08514 2/20 0.31
HSD17B10 Q99714 1/20 0.31
FNTA P49354 1/20 0.30
FNTB P49356 1/20 0.30
LMNA P02545 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
SCHEMBL4516857 0.81 POLB (0.42) SMN1; SMN2ACE
Acetylcysteine SCHEMBL26614424 0.72 MAPT (0.91) SMN1; SMN2KDM4EMAPTTHRBALOX15
Acetylcysteine SCHEMBL3923959 0.72 MAPT (1.00) SMN1; SMN2KDM4EMAPTTHRBALOX15
Acetylcysteine SCHEMBL3923962 0.72 MAPT (1.00) SMN1; SMN2KDM4EMAPTTHRBALOX15
Acetylcysteine SCHEMBL4433756 0.72 MAPT (1.00) SMN1; SMN2KDM4EMAPTTHRBALOX15
Acetylcysteine SCHEMBL1384791 0.72 MAPT (1.00) SMN1; SMN2KDM4EMAPTTHRBALOX15
Acetylcysteine SCHEMBL3688241 0.72 MAPT (1.00) SMN1; SMN2KDM4EMAPTTHRBALOX15
Acetylcysteine SCHEMBL4437350 0.72 MAPT (1.00) SMN1; SMN2KDM4EMAPTTHRBALOX15
Acetylcysteine SCHEMBL4437351 0.72 MAPT (1.00) SMN1; SMN2KDM4EMAPTTHRBALOX15
Acetylcysteine SCHEMBL5292 0.72 MAPT (1.00) SMN1; SMN2KDM4EMAPTTHRBALOX15

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-2008012756-A2 PEST ATTRACTANT COMPOSITION ACTIVETRAD (PROPRIETARY) LIMITED (ZA) 2008-01-31 WO disclosed