Triaziquone

Triaziquone

SCHEMBL626502

Cl.NC(CO)(CO)CO.O.O.O=C1C=C(N2CC2)C(=O)C(N2CC2)=C1N1CC1

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

DHFRGARTPTGFRPTGIRPTGS1PTGS2TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8envmurAthyA

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

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 1/20 0.35
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
STAT3 P40763 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
KMT2A Q03164 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
Triaziquone SCHEMBL9125279 0.98 DNMT1 (0.36) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL207077 0.98 DNMT1 (0.36) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL93807 0.97 DNMT1 (0.37) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL8482977 0.97 DNMT1 (0.37) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL5697804 0.91 MAPT (0.38) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL8058737 0.91 MAPT (0.35) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL16684529 0.89 MAPT (0.40) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL6259658 0.88 MAPT (0.41) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL3641977 0.88 DNMT1 (0.31) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL17609997 0.86 MAPT (0.37) DNMT1TP53MAPTSTAT3HTT

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-2012021907-A2 VINCRISTINE IMMUNOASSAY SALADAX BIOMEDICAL INC. (US) 2012-02-16 WO disclosed