Deoxyadenosine

Deoxyadenosine

SCHEMBL10012867

Cc1cn([C@H]2CC[C@@H](CO)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1.Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DTYMK P23919 4/20 0.61
HIF1A Q16665 1/20 0.51
LMNA P02545 2/20 0.50
ALDH1A1 P00352 1/20 0.50
ALB P02768 1/20 0.50
MAPK1 P28482 1/20 0.50
FPR2 P25090 1/20 0.49
DNMT1 P26358 1/20 0.49
DNMT3B Q9UBC3 1/20 0.49
PNP P00491 1/20 0.48
TP53 P04637 1/20 0.48
HTT P42858 1/20 0.48
PDE4D Q08499 1/20 0.48
PDE3A Q14432 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48

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
Deoxyadenosine SCHEMBL20819422 0.94 DTYMK (0.67) DTYMKHIF1ALMNAFPR2DNMT1
Adenosine SCHEMBL531208 0.88 DTYMK (0.76) DTYMKMAPK1FPR2DNMT1DNMT3B
Adenosine SCHEMBL574772 0.88 DTYMK (0.63) DTYMKMAPK1SMN1; SMN2
Deoxyguanosine SCHEMBL6373906 0.88 F2 (0.54) DTYMKLMNAALDH1A1ALBMAPK1
Adenosine SCHEMBL6863617 0.88 DTYMK (0.76) DTYMKMAPK1FPR2DNMT1DNMT3B
Deoxyadenosine SCHEMBL8028657 0.86 DTYMK (0.58) DTYMKHIF1ALMNAALBFPR2
Adenosine SCHEMBL6247607 0.86 DTYMK (0.58) DTYMKLMNAALDH1A1ALBMAPK1
Doxribtimine SCHEMBL1592249 0.85 TK1 (0.64) LMNAALBSMN1; SMN2
Deoxyadenosine SCHEMBL3817507 0.85 DTYMK (0.85) DTYMKALDH1A1SMN1; SMN2
SCHEMBL8926799 0.84 DTYMK (0.78) DTYMK

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
US-20160186241-A1 BUFFERS FOR THE STABLE STORAGE OF NUCLEIC ACIDS IBIS BIOSCIENCES, INC. 2016-06-30 US disclosed
US-9279145-B2 Buffers for the stable storage of nucleic acids IBIS BIOSCIENCES, INC. (US) 2016-03-08 US disclosed
WO-2012092541-A1 BUFFERS FOR THE STABLE STORAGE OF NUCLEIC ACIDS IBIS BIOSCIENCES, INC. (US) 2012-07-05 WO disclosed
US-20120171685-A1 BUFFERS FOR THE STABLE STORAGE OF NUCLEIC ACIDS IBIS BIOSCIENCES, INC. (US) 2012-07-05 US disclosed