SCHEMBL9109579

SCHEMBL9109579

CNc1ncnc2c1nc(Br)n2[C@H]1CC(O)[C@@H](CO)O1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 1/20 0.50
▸ ADORA3 P0DMS8 2/20 0.47
▸ ADORA2A P29274 1/20 0.47
▸ SLC29A1 Q99808 1/20 0.44
▸ ADK P55263 1/20 0.43
▸ PIM1 P11309 1/20 0.43
▸ CSNK2A2 P19784 1/20 0.43
▸ CSNK2B P67870 1/20 0.43
▸ CSNK2A1 P68400 1/20 0.43
▸ CSNK2A3 Q8NEV1 1/20 0.43
▸ HSPA5 P11021 1/20 0.41
▸ HSPA8 P11142 1/20 0.41

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
SCHEMBL9109570 1.00 HIF1A (0.50) HIF1AADORA3ADORA2ASLC29A1ADK
SCHEMBL5983118 0.88 HSPA5 (0.52) HIF1AADORA3ADORA2ASLC29A1HSPA5
SCHEMBL9108380 0.88 HIF1A (0.48) HIF1AADORA3ADORA2ASLC29A1ADK
SCHEMBL5983106 0.88 HSPA5 (0.52) HIF1AADORA3ADORA2ASLC29A1HSPA5
SCHEMBL9108372 0.88 HIF1A (0.48) HIF1AADORA3ADORA2ASLC29A1ADK
SCHEMBL9105940 0.87 HIF1A (0.47) HIF1AADORA3ADORA2ASLC29A1ADK
SCHEMBL9105928 0.87 HIF1A (0.47) HIF1AADORA3ADORA2ASLC29A1ADK
SCHEMBL5983406 0.87 ADK (0.49) HIF1AADORA3ADORA2AADK
SCHEMBL5983403 0.87 ADK (0.49) HIF1AADORA3ADORA2AADK
SCHEMBL5981546 0.85 HIF1A (0.52) HIF1AADORA3ADORA2AADKPIM1

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-0558634-A4 TRIPLEX-FORMING OLIGOMERS CONTAINING MODIFIED BASES GILEAD SCIENCES INC (US) 1995-06-28 — — EP disclosed
EP-0558634-A1 TRIPLEX-FORMING OLIGOMERS CONTAINING MODIFIED BASES GILEAD SCIENCES, INC. (US) 1993-09-08 — — EP disclosed
WO-1992010590-A1 INHIBITION OF TRANSCRIPTION BY FORMATION OF TRIPLE HELIXES GILEAD SCIENCES, INC. (US) 1992-06-25 — — WO disclosed
WO-1992009705-A1 TRIPLEX-FORMING OLIGOMERS CONTAINING MODIFIED BASES GILEAD SCIENCES, INC. (US) 1992-06-11 — — WO disclosed
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