Azathioprine

Azathioprine

SCHEMBL7757150

Cn1cnc([N+](=O)[O-])c1Sc1ncnc2nc[nH]c12.[N-]=[N+]=CC(=O)OC[C@H](N)C(=O)O

nearest known ligand 0.62

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 4/20 0.62
TP53 P04637 3/20 0.62
HBB P68871 2/20 0.62
GMNN O75496 1/20 0.62
LMNA P02545 1/20 0.62
PGR P06401 1/20 0.62
CYP3A4 P08684 1/20 0.62
SLC6A4 P31645 1/20 0.62
BLM P54132 1/20 0.62
PMP22 Q01453 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
TDP1 Q9NUW8 1/20 0.62
KDM4E B2RXH2 2/20 0.46
NPC1 O15118 1/20 0.46
CCR6 P51684 1/20 0.39
CYP2C19 P33261 1/20 0.38
HSP90AA1 P07900 1/20 0.38
HTT P42858 1/20 0.35
ALDH1A1 P00352 4/20 0.35
RAB9A P51151 1/20 0.35

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 SCHEMBL2321074 0.81 MAPT (0.70) MAPTTP53HBBGMNNLMNA
Azathioprine SCHEMBL2328735 0.80 MAPT (0.82) MAPTTP53HBBGMNNLMNA
Azathioprine SCHEMBL4259183 0.79 MAPT (0.84) MAPTTP53HBBGMNNLMNA
Azathioprine SCHEMBL4278 0.79 MAPT (1.00) MAPTTP53HBBGMNNLMNA
Azathioprine SCHEMBL29693611 0.79 MAPT (1.00) MAPTTP53HBBGMNNLMNA
Azathioprine SCHEMBL4436347 0.79 MAPT (1.00) MAPTTP53HBBGMNNLMNA
Azathioprine SCHEMBL3089846 0.78 MAPT (0.98) MAPTTP53HBBGMNNLMNA
Azathioprine SCHEMBL26152 0.78 MAPT (0.98) MAPTTP53HBBGMNNLMNA
Azathioprine SCHEMBL502599 0.78 MAPT (0.98) MAPTTP53HBBGMNNLMNA
Azathioprine SCHEMBL317904 0.78 MAPT (0.98) MAPTTP53HBBGMNNLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1078091-A2 GENE THERAPY VECTORS AND THEIR USE IN ANTITUMOUR THERAPY CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 2001-02-28 EP claimed
WO-1999060142-A2 GENE THERAPY VECTORS AND THEIR USE IN ANTITUMOUR THERAPY CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1999-11-25 WO claimed
EP-1078091-A2 GENE THERAPY VECTORS AND THEIR USE IN ANTITUMOUR THERAPY CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 2001-02-28 EP disclosed
WO-1999060142-A2 GENE THERAPY VECTORS AND THEIR USE IN ANTITUMOUR THERAPY CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1999-11-25 WO disclosed