SCHEMBL6898326

SCHEMBL6898326

CCO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)ncnc21

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 4/20 0.72
▸ ADORA1 P30542 2/20 0.72
▸ PI4KA P42356 2/20 0.72
▸ PI4K2B Q8TCG2 2/20 0.72
▸ PI4K2A Q9BTU6 2/20 0.72
▸ PI4KB Q9UBF8 2/20 0.72
▸ ADORA2A P29274 2/20 0.72
▸ ADORA2B P29275 2/20 0.72
▸ DPP4 P27487 1/20 0.72
▸ MEN1 O00255 1/20 0.72
▸ SLC28A1 O00337 1/20 0.72
▸ MAP3K7 O43318 1/20 0.72
▸ SLC28A2 O43868 1/20 0.72
▸ GAPDH P04406 1/20 0.72
▸ MAPK1 P28482 1/20 0.72
▸ STAT6 P42226 1/20 0.72
▸ KMT2A Q03164 1/20 0.72
▸ SMN1; SMN2 Q16637 1/20 0.72
▸ DOT1L Q8TEK3 1/20 0.72
▸ SLC29A1 Q99808 1/20 0.72

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
SCHEMBL5559352 1.00 ADORA3 (0.72) ADORA3ADORA1PI4KAPI4K2BPI4K2A
SCHEMBL29722344 1.00 ADORA3 (0.72) ADORA3ADORA1PI4KAPI4K2BPI4K2A
SCHEMBL6898569 0.93 ADORA3 (0.71) ADORA3ADORA1PI4KAPI4K2BPI4K2A
SCHEMBL29705802 0.93 ADORA3 (0.71) ADORA3ADORA1PI4KAPI4K2BPI4K2A
SCHEMBL6898572 0.93 ADORA3 (0.71) ADORA3ADORA1PI4KAPI4K2BPI4K2A
SCHEMBL23466944 0.93 ADORA3 (0.71) ADORA3ADORA1PI4KAPI4K2BPI4K2A
SCHEMBL13777063 0.92 ADORA3 (0.72) ADORA3ADORA1PI4KAPI4K2BPI4K2A
SCHEMBL28804979 0.91 ADORA3 (0.75) ADORA3ADORA1PI4KAPI4K2BPI4K2A
SCHEMBL6892950 0.91 ADORA3 (0.68) ADORA3ADORA1PI4KAPI4K2BPI4K2A
SCHEMBL29705721 0.91 ADORA3 (0.68) ADORA3ADORA1PI4KAPI4K2BPI4K2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1418179-A2 Compositions and methods for detecting and modulating rna activity and gene expression ISIS PHARMACEUTICALS, INC. (US) 2004-05-12 — — EP disclosed
US-5773603-A ADENOSINE DEAMINASE INHIBITOR NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1998-06-30 — — US disclosed
EP-0601322-A2 Adenosindeaminase inhibitor NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1994-06-15 — — EP disclosed
EP-0269574-B1 NOVEL ADENOSINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AS AN ACTIVE INGREDIENT NIPPON ZOKI PHARMACEUTICAL CO. LTD. (JP) 1992-03-18 — — EP disclosed
US-4843066-A HYPOTENSIVE AGENTS NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1989-06-27 — — US disclosed
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