Azathioprine

Azathioprine

SCHEMBL4259183

Cn1cnc([N+](=O)[O-])c1Sc1ncnc2nc[nH]c12.O=C(O)CCC(=O)O

nearest known ligand 0.84

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PPAT

The experimentally established mechanism targets of Azathioprine. 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
MAPT P10636 6/20 0.84
HBB P68871 2/20 0.84
LMNA P02545 2/20 0.84
GMNN O75496 1/20 0.84
TP53 P04637 1/20 0.84
PGR P06401 1/20 0.84
CYP3A4 P08684 1/20 0.84
SLC6A4 P31645 1/20 0.84
BLM P54132 1/20 0.84
PMP22 Q01453 1/20 0.84
SMN1; SMN2 Q16637 1/20 0.84
TDP1 Q9NUW8 1/20 0.84
KDM4E B2RXH2 1/20 0.61
NPC1 O15118 1/20 0.61
CYP2C19 P33261 2/20 0.53
ALDH1A1 P00352 5/20 0.46
RAB9A P51151 1/20 0.46
HPGD P15428 1/20 0.46
CDC7 O00311 2/20 0.45
DBF4 Q9UBU7 2/20 0.45

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
Azathioprine SCHEMBL4252041 0.96 MAPT (0.78) MAPTHBBLMNAGMNNTP53
Azathioprine SCHEMBL2328735 0.93 MAPT (0.82) MAPTHBBLMNAGMNNTP53
Azathioprine SCHEMBL29693611 0.92 MAPT (1.00) MAPTHBBLMNAGMNNTP53
Azathioprine SCHEMBL4436347 0.92 MAPT (1.00) MAPTHBBLMNAGMNNTP53
Azathioprine SCHEMBL4278 0.92 MAPT (1.00) MAPTHBBLMNAGMNNTP53
Azathioprine SCHEMBL26152 0.91 MAPT (0.98) MAPTHBBLMNAGMNNTP53
Azathioprine SCHEMBL502599 0.91 MAPT (0.98) MAPTHBBLMNAGMNNTP53
Azathioprine SCHEMBL317904 0.91 MAPT (0.98) MAPTHBBLMNAGMNNTP53
Azathioprine SCHEMBL3089846 0.91 MAPT (0.98) MAPTHBBLMNAGMNNTP53
Azathioprine SCHEMBL2321074 0.84 MAPT (0.70) MAPTHBBLMNAGMNNTP53

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
US-20090306625-A1 TREATMENT SYSTEMS AND METHODS FOR RENAL-RELATED DISEASES ANGIODYNAMICS, INC. (US) 2009-12-10 US disclosed
WO-2009114826-A2 TREATMENT SYSTEMS AND METHODS FOR RENAL-RELATED DISEASES ANGIODYNAMICS, INC. (US) 2009-09-17 WO disclosed