Triaziquone

Triaziquone

SCHEMBL14957751

NCC(=O)O.O=C1C=C(N2CC2)C(=O)C(N2CC2)=C1N1CC1.O=P(O)(O)O

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

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 6)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 1/20 0.34
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

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 SCHEMBL3505984 0.92 DNMT1 (0.37) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL7996887 0.92 DNMT1 (0.37) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL9678206 0.89 DNMT1 (0.39) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL23087090 0.88 DNMT1 (0.38) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL62271 0.87 DNMT1 (0.42) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL3903553 0.87 DNMT1 (0.42) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL1445124 0.86 TP53 (0.38) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL11314127 0.86 DNMT1 (0.37) DNMT1TP53MAPTSTAT3HTT
Triaziquone SCHEMBL5800741 0.86 DNMT1 (0.41) DNMT1TP53MAPTSTAT3HTT
Edetic Acid SCHEMBL4225221 0.83 TDP1 (0.37) DNMT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190202919-A1 PURIFICATION OF ANTI-C-MET ANTIBODIES GENENTECH, INC. (US) 2019-07-04 US disclosed
US-20150050275-A1 PURIFICATION OF ANTI-C-MET ANTIBODIES GENENTECH, INC. (US) 2015-02-19 US disclosed
US-20130129718-A1 PURIFICATION OF ANTI-C-MET ANTIBODIES GENENTECH, INC. (US) 2013-05-23 US disclosed