SCHEMBL6429185

SCHEMBL6429185

COC[C@H]1O[C@@H](n2cnc3c(NC(=O)C(C)C)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 4/20 0.66
ADORA1 P30542 3/20 0.59
PRMT5 O14744 2/20 0.57
WDR77 Q9BQA1 2/20 0.57
P2RY12 Q9H244 1/20 0.56
PRKAG1 P54619 1/20 0.54
PRKAA1 Q13131 1/20 0.54
PRKAB1 Q9Y478 1/20 0.54
TARS1 P26639 1/20 0.53

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
SCHEMBL3499233 0.89 ADORA2A (0.64)
SCHEMBL3499237 0.89 ADORA2A (0.64)
SCHEMBL8164945 0.87 ADORA3 (0.54) ADORA3ADORA1
SCHEMBL2033392 0.86 TARS1 (0.60) ADORA3ADORA1PRMT5WDR77P2RY12
SCHEMBL2056705 0.86 ADORA3 (0.60) ADORA3ADORA1PRMT5WDR77P2RY12
SCHEMBL9413282 0.85 ADORA3 (0.74) ADORA3ADORA1
SCHEMBL9620148 0.85 ADORA3 (0.74) ADORA3ADORA1
SCHEMBL6661320 0.83 ADORA3 (0.67) ADORA3ADORA1PRKAG1PRKAA1PRKAB1
SCHEMBL6661329 0.83 ADORA3 (0.67) ADORA3ADORA1
SCHEMBL2761074 0.83 MEN1 (0.66) ADORA3ADORA1PRKAG1PRKAA1PRKAB1

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
US-20050176045-A1 SNP discriminatory siRNA DHARMACON, INC. (US) 2005-08-11 US disclosed