Dl-Dithiothreitol

Dl-Dithiothreitol

SCHEMBL23883128

NC(CS)C(=O)O.OCC(O)CS.OCCS.O[C@H](CS)[C@H](O)CS

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.55
SLC7A11 Q9UPY5 1/20 0.55
LMNA P02545 1/20 0.45
SLC1A1 P43005 2/20 0.36
USP2 O75604 1/20 0.35
SLCO1B1 Q9Y6L6 1/20 0.35
ENPEP Q07075 5/20 0.33
ANPEP P15144 1/20 0.32
SLC7A5 Q01650 1/20 0.31
GRM8 O00222 1/20 0.31
GRM6 O15303 1/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GSR P00390 1/20 0.31
CYP1A2 P05177 1/20 0.31
GRIK1 P39086 1/20 0.31
GRM5 P41594 1/20 0.31
GRIA1 P42261 1/20 0.31
GRIA2 P42262 1/20 0.31
GRIA3 P42263 1/20 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
Dl-Dithiothreitol SCHEMBL23883129 1.00 PTGS1 (0.55) PTGS1SLC7A11LMNASLC1A1USP2
Cysteine SCHEMBL3396295 0.89 PTGS1 (0.70) PTGS1SLC7A11LMNASLC1A1USP2
Cysteine SCHEMBL3396289 0.89 PTGS1 (0.70) PTGS1SLC7A11LMNASLC1A1USP2
Cysteine SCHEMBL888041 0.83 PTGS1 (0.73) PTGS1SLC7A11LMNASLC1A1USP2
Cysteine SCHEMBL888042 0.83 PTGS1 (0.73) PTGS1SLC7A11LMNASLC1A1USP2
Cysteine SCHEMBL8660333 0.83 PTGS1 (0.80) PTGS1SLC7A11SLC1A1ENPEPANPEP
Cysteine SCHEMBL8660332 0.83 PTGS1 (0.80) PTGS1SLC7A11SLC1A1ENPEPANPEP
Dl-Dithiothreitol SCHEMBL28838774 0.83 PTGS1 (0.80) PTGS1SLC7A11SLC1A1ENPEPANPEP
Cysteine SCHEMBL27658901 0.77 PTGS1 (0.84) PTGS1SLC7A11SLC1A1ENPEPANPEP
Mannitol SCHEMBL9223735 0.76 PTGS1 (0.67) PTGS1SLC7A11LMNASLC1A1USP2

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
WO-2021201202-A1 ANALYSIS METHOD FOR IMPURITY MOLECULES IN COMPOSITION CONTAINING MULTI-SPECIFIC ANTIGEN-BINDING MOLECULES 中外製薬株式会社 2021-10-07 WO claimed
WO-2021201202-A1 ANALYSIS METHOD FOR IMPURITY MOLECULES IN COMPOSITION CONTAINING MULTI-SPECIFIC ANTIGEN-BINDING MOLECULES 中外製薬株式会社 2021-10-07 WO disclosed