Glutathione

Glutathione

SCHEMBL3765549

C=C(CC)C(=O)c1ccc(OCC(=O)O)c(Cl)c1Cl.NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC12A1

The experimentally established mechanism targets of Glutathione. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSTP1 P09211 11/20 0.57
▸ GSTA1 P08263 9/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ ABCC3 O15438 1/20 0.57
▸ PLIN1 O60240 1/20 0.57
▸ ALDH1A1 P00352 1/20 0.57
▸ LMNA P02545 1/20 0.57
▸ TP53 P04637 1/20 0.57
▸ MAPT P10636 1/20 0.57
▸ HSPD1 P10809 1/20 0.57
▸ CYP2C9 P11712 1/20 0.57
▸ TSHR P16473 1/20 0.57
▸ HTT P42858 1/20 0.57
▸ RECQL P46063 1/20 0.57
▸ MAP2K6 P52564 1/20 0.57
▸ HSPE1 P61604 1/20 0.57
▸ GSTO1 P78417 1/20 0.57
▸ PLIN5 Q00G26 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ ATM Q13315 1/20 0.57

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
Ethacrynic Acid SCHEMBL16507499 0.79 GSTP1 (0.71) GSTP1GSTA1MEN1ABCC3PLIN1
SCHEMBL15288975 0.79 PTGS1 (0.46) GSTP1GSTA1MEN1ABCC3PLIN1
SCHEMBL9717560 0.77 GSTP1 (0.80) GSTP1GSTA1MEN1ABCC3PLIN1
Glutathione SCHEMBL28002787 0.77 PTGS1 (0.90) PTGS1GSTK1GLO1
Glutathione SCHEMBL3395426 0.76 PTGS1 (0.92) PTGS1GSTK1GLO1
Ethacrynic Acid SCHEMBL9108011 0.76 GSTP1 (1.00) GSTP1GSTA1MEN1ABCC3PLIN1
Glutathione SCHEMBL17629816 0.75 PTGS1 (0.90) PTGS1GSTK1GLO1
Glutathione SCHEMBL28101166 0.75 PTGS1 (0.90) PTGS1GSTK1GLO1
Glutathione SCHEMBL28101167 0.75 PTGS1 (0.90) PTGS1GSTK1GLO1
Glutathione SCHEMBL4958127 0.75 PTGS1 (0.90) PTGS1GSTK1GLO1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7846746-B2 Methods of analysis and labeling of protein-protein interactions CHILDREN'S MEDICAL CENTER CORPORATION (US) 2010-12-07 — — US disclosed
EP-1377828-A4 METHODS OF ANALYSIS AND LABELING OF PROTEIN-PROTEIN INTERACTIONS CHILDRENS MEDICAL CENTER (US) 2006-11-15 — — EP disclosed
US-20050004038-A1 Bivalent inhibitors of Glutathione-S-Transferases NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2005-01-06 — — US disclosed
US-20040157279-A1 Methods of analysis and labeling of protein-protein interactions NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2004-08-12 — — US disclosed
US-6747009-B2 METABOLICALLY STABLE INHIBITORS OF GLUTATHIONE S-TRANSFERASE; TREATING CANCER UNIVERSITEIT LEIDEN (NL) 2004-06-08 — — US disclosed
US-20040063640-A1 PEPTIDOMIMETIC GLUTATHIONE ANALOGS UNIVERSITEIT LEIDEN 2004-04-01 — — US disclosed
EP-1377828-A2 METHODS OF ANALYSIS AND LABELING OF PROTEIN-PROTEIN INTERACTIONS CHILDREN'S MEDICAL CENTER CORPORATION (US) 2004-01-07 — — EP disclosed
WO-2002083846-A9 METHODS OF ANALYSIS AND LABELING OF PROTEIN-PROTEIN INTERACTIONS CHILDRENS MEDICAL CENTER (US) 2003-06-19 — — WO disclosed
WO-2002083846-A2 METHODS OF ANALYSIS AND LABELING OF PROTEIN-PROTEIN INTERACTIONS CHILDREN'S MEDICAL CENTER CORPORATION (US) 2002-10-24 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050004038-A1 Bivalent inhibitors of Glutathione-S-Transferases GSTM1, GSTM2, GSTA2 GSTP1 5/4885GSTA1 4/4885MEN1 3583/4885
US-20040063640-A1 PEPTIDOMIMETIC GLUTATHIONE ANALOGS GSTM1, GSTM2, GSTP1 GSTP1 3/4885GSTA1 4/4885MEN1 2923/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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