SCHEMBL27641587

SCHEMBL27641587

C[C@@H](O)[C@H](NC(=O)Nc1ncnc2c1ncn2C1(O)O[C@H](CO)[C@@H](O)[C@H]1O)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SLC29A1 Q99808 1/20 0.38
▸ ADORA3 P0DMS8 2/20 0.38
▸ ADORA2A P29274 2/20 0.38
▸ ADORA2B P29275 1/20 0.38
▸ ADORA1 P30542 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ NFKB1 P19838 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ PMP22 Q01453 1/20 0.38

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
SCHEMBL27721224 0.87 HTR2B (0.34) ADORA3ADORA2AADORA1
SCHEMBL21274225 0.85 TARS1 (0.37) SLC29A1ADORA3ADORA2AADORA1
SCHEMBL30674291 0.85 TARS1 (0.37) SLC29A1ADORA3ADORA2AADORA1
SCHEMBL26646333 0.83 ADORA2A (0.40) SLC29A1ADORA2AADORA2B
SCHEMBL30379388 0.81 ADORA3 (0.37) SLC29A1ADORA3ADORA2AADORA2BADORA1
SCHEMBL63154 0.80 ADORA3 (0.59) ADORA3ADORA2AADORA2BADORA1TP53
SCHEMBL7893576 0.80 ADORA3 (0.59) ADORA3ADORA2AADORA2BADORA1TP53
SCHEMBL10927483 0.80 ADORA3 (0.59) ADORA3ADORA2AADORA2BADORA1TP53
SCHEMBL2530355 0.80 ADORA3 (0.59) ADORA3ADORA2AADORA2BADORA1TP53
SCHEMBL18503542 0.80 ADORA3 (0.59) ADORA3ADORA2AADORA2BADORA1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101027390-B Lrp4/Corin dopaminergic neuron progenitor cell marker EISAI CO LTD 2012-12-12 — — CN disclosed
CN-101243316-A Porous composite electrode containing conductive polymer APPLERA CORP (US) 2008-08-13 — — CN disclosed
CN-101068813-A Determination of Nucleic Acids Using Electrocatalytic Intercalators AGENCY SCIENCE TECH & RES (SG) 2007-11-07 — — CN disclosed
CN-101060864-A Delivery of polynucleotides ANESIVA INC (US) 2007-10-24 — — CN disclosed
CN-101027390-A Lrp4/Corin dopamine-producing neuron precursor cell marker EISAI CO LTD (JP) 2007-08-29 — — CN disclosed
CN-1745488-A Chemical switching of nucleic acid circuit elements UNIV SASKATCHEWAN (CA) 2006-03-08 — — CN disclosed
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