SCHEMBL9810606

SCHEMBL9810606

COc1nc2c(N)ncnc2n1[C@H]1CC(O)[C@@H](CO)O1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 1/20 0.61
▸ ADORA2A P29274 1/20 0.61
▸ HSPA5 P11021 2/20 0.51
▸ HSPA8 P11142 2/20 0.51
▸ RXFP1 Q9HBX9 2/20 0.51
▸ TRPM2 O94759 1/20 0.49
▸ HIF1A Q16665 1/20 0.47
▸ SLC28A2 O43868 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ TP53 P04637 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ PNP P00491 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ PDE4D Q08499 1/20 0.47
▸ PDE3A Q14432 1/20 0.47
▸ HBB P68871 1/20 0.46
▸ FBP1 P09467 1/20 0.45
▸ ATG7 O95352 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ GAPDH P04406 1/20 0.45

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
SCHEMBL9810594 1.00 ADORA3 (0.61) ADORA3ADORA2AHSPA5HSPA8RXFP1
SCHEMBL5983148 0.88 HIF1A (0.51) ADORA3ADORA2ARXFP1HIF1ALMNA
SCHEMBL5983156 0.88 HIF1A (0.51) ADORA3ADORA2ARXFP1HIF1ALMNA
SCHEMBL19121006 0.86 ADORA3 (0.64) ADORA3ADORA2AHSPA5HSPA8RXFP1
SCHEMBL13479946 0.86 ADORA3 (0.64) ADORA3ADORA2AHSPA5HSPA8RXFP1
SCHEMBL5982465 0.85 ADORA3 (0.67) ADORA3ADORA2AHSPA5HSPA8RXFP1
SCHEMBL5982454 0.85 ADORA3 (0.67) ADORA3ADORA2AHSPA5HSPA8RXFP1
SCHEMBL658005 0.85 ADORA3 (0.67) ADORA3ADORA2AHSPA5HSPA8RXFP1
SCHEMBL658006 0.85 ADORA3 (0.67) ADORA3ADORA2AHSPA5HSPA8RXFP1
SCHEMBL23215196 0.85 ADORA3 (0.67) ADORA3ADORA2AHSPA5HSPA8RXFP1

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-5013829-A Stable congener of 2',3'-dideoxyadenosine UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 1991-05-07 — — US disclosed
Send feedback