SCHEMBL8523567

SCHEMBL8523567

CCCCCNc1ncnc2c1cnn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.86

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SLC29A1 Q99808 3/20 0.66
▸ ADORA1 P30542 4/20 0.49
▸ ADORA3 P0DMS8 2/20 0.49
▸ ADORA2A P29274 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ NFKB1 P19838 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ NFKB2 Q00653 1/20 0.48
▸ RELA Q04206 1/20 0.48
▸ SMN1; SMN2 Q16637 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
SCHEMBL29600893 0.84 ADK (0.58) —
SCHEMBL30047434 0.82 ADA (0.52) ALDH1A1LMNATP53SMN1; SMN2
SCHEMBL29601078 0.82 ATG7 (0.53) SLC29A1ADORA1ADORA3ADORA2AALDH1A1
SCHEMBL11210320 0.81 SLC29A1 (0.48) SLC29A1ADORA3
SCHEMBL30935808 0.80 SLC29A1 (0.52) SLC29A1
SCHEMBL29273715 0.80 SLC29A1 (0.52) SLC29A1
SCHEMBL8975931 0.79 ADK (0.71) SLC29A1NPC1ALDH1A1LMNATSHR
SCHEMBL6758644 0.79 SLC29A1 (0.98) SLC29A1ADORA1ADORA3ADORA2ATSHR
SCHEMBL8328951 0.79 SLC29A1 (0.98) SLC29A1ADORA1ADORA3ADORA2ATSHR
SCHEMBL31628603 0.79 SLC29A1 (0.98) SLC29A1ADORA1ADORA3ADORA2ATSHR

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-0496617-B1 Adenosine kinase inhibitors METABASIS THERAPEUTICS INC (US) 1999-12-01 — — EP disclosed
US-5646128-A TREATING INFLAMMATION, SEPSIS, SEPTIC SHOCK, BURNS GENSIA, INC. (US) 1997-07-08 — — US disclosed
WO-1992012718-A1 ADENOSINE KINASE INHIBITORS GENSIA, INC. (US) 1992-08-06 — — WO disclosed
EP-0496617-A1 Adenosine kinase inhibitors GENSIA, INC. (US) 1992-07-29 — — EP disclosed
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