Tabun

Tabun

SCHEMBL3915542

CCOP(=O)(C#N)N(C)C.CCOP(=O)(C#N)N(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 1.00
TSHR P16473 2/20 0.42
TP53 P04637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
LMNA P02545 2/20 0.33
KMT2A Q03164 2/20 0.33
PPARD Q03181 2/20 0.32
ALDH1A1 P00352 1/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 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
Tabun SCHEMBL30409655 1.00 ACHE (1.00) ACHETSHRTP53TDP1LMNA
Tabun SCHEMBL60863 1.00 ACHE (1.00) ACHETSHRTP53TDP1LMNA
Tabun SCHEMBL29644762 0.98 ACHE (0.96) ACHETSHRTP53TDP1LMNA
Tabun SCHEMBL29676743 0.98 ACHE (0.96) ACHETSHRTP53TDP1LMNA
Tabun SCHEMBL29828654 0.96 ACHE (0.92) ACHETSHRTP53TDP1LMNA
Tabun SCHEMBL7874201 0.89 ACHE (0.79) ACHETSHRTP53TDP1LMNA
Tabun SCHEMBL29583505 0.83 ACHE (0.69) ACHETSHRPPARD
SCHEMBL13412912 0.83 ACHE (0.70) ACHETSHRKMT2AMEN1
Tabun SCHEMBL9292835 0.82 ACHE (0.67) ACHELMNAKMT2AALDH1A1MEN1
Tabun SCHEMBL1976996 0.82 ACHE (0.67) ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101500600-A Methods for ester detoxication HUMAN BIOMOLECULAR RES INST (US) 2009-08-05 CN disclosed
EP-2035032-A2 METHODS FOR ESTER DETOXICATION Human Biomolecular Research Institute (US) 2009-03-18 EP disclosed
WO-2007146003-A2 METHODS FOR ESTER DETOXICATION HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2007-12-21 WO disclosed
WO-2004108172-A1 METAL OXIDE DECONTAMINATION OF WARFARE AGENTS NANOSCALE MATERIALS, INC. (US) 2004-12-16 WO disclosed
WO-2004053891-A2 SYSTEM FOR CONTROL OF CHEMICAL / BIOLOGICAL WARFARE AGENTS NANOSCALE MATERIALS, INC. (US) 2004-06-24 WO disclosed