Azacitidine

Azacitidine

SCHEMBL16498253

CC(C)=O.Nc1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1

nearest known ligand 0.90

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

DNMT1DNMT3A

The experimentally established mechanism targets of Azacitidine. 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
▸ DNMT1 known ✓ P26358 2/20 0.90
▸ LMNA P02545 2/20 0.90
▸ MTOR P42345 2/20 0.90
▸ TP53 P04637 2/20 0.90
▸ ALDH1A1 P00352 2/20 0.90
▸ HTT P42858 2/20 0.90
▸ BLM P54132 2/20 0.90
▸ GMNN O75496 1/20 0.90
▸ NFKB1 P19838 1/20 0.90
▸ THPO P40225 1/20 0.90
▸ RAB9A P51151 1/20 0.90
▸ HBB P68871 1/20 0.90
▸ PMP22 Q01453 1/20 0.90
▸ THRB P10828 1/20 0.59
▸ MDM2 Q00987 1/20 0.59
▸ NCOA1 Q15788 1/20 0.59
▸ NCOA3 Q9Y6Q9 1/20 0.59
▸ KDM4E B2RXH2 2/20 0.58
▸ MAPT P10636 2/20 0.58
▸ TDP1 Q9NUW8 1/20 0.58

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
Azacitidine SCHEMBL27819363 0.96 LMNA (0.88) LMNAMTORTP53DNMT1ALDH1A1
Azacitidine SCHEMBL13376157 0.95 LMNA (1.00) LMNAMTORTP53DNMT1ALDH1A1
Azacitidine SCHEMBL19060381 0.95 LMNA (1.00) LMNAMTORTP53DNMT1ALDH1A1
Azacitidine SCHEMBL169369 0.95 LMNA (1.00) LMNAMTORTP53DNMT1ALDH1A1
Azacitidine SCHEMBL18055593 0.95 LMNA (1.00) LMNAMTORTP53DNMT1ALDH1A1
Azacitidine SCHEMBL23815524 0.95 LMNA (1.00) LMNAMTORTP53DNMT1ALDH1A1
Azacitidine SCHEMBL7146234 0.95 LMNA (1.00) LMNAMTORTP53DNMT1ALDH1A1
Azacitidine SCHEMBL16187746 0.95 LMNA (1.00) LMNAMTORTP53DNMT1ALDH1A1
Azacitidine SCHEMBL2412035 0.95 LMNA (1.00) LMNAMTORTP53DNMT1ALDH1A1
Azacitidine SCHEMBL706302 0.95 LMNA (1.00) LMNAMTORTP53DNMT1ALDH1A1

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-2011153374-A1 PRODRUGS OF AZACITIDINE 5'-PHOSPHATE SYNDAX PHARMACEUTICALS INC. (US) 2011-12-08 — — WO disclosed
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