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Formic Acid

Formic Acid

SCHEMBL7104783

Cc1cnc([C@H]2O[C@@H](n3cnc4c(NCCC5CCCCC5)nc(N(CO)CCc5ccccc5)nc43)[C@H](O)[C@@H]2O)o1.O=CO

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 9/20 0.45
▸ PGK1 P00558 3/20 0.42
▸ PGK2 P07205 3/20 0.42
▸ ADORA3 P0DMS8 6/20 0.41
▸ ADORA1 P30542 5/20 0.41
▸ ADORA2B P29275 2/20 0.41
▸ NFKB1 P19838 1/20 0.39
▸ THPO P40225 1/20 0.39
▸ TSHR P16473 1/20 0.39

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
SCHEMBL7103493 0.97 ADORA2A (0.47) ADORA2APGK1PGK2ADORA3ADORA1
SCHEMBL7104790 0.93 ADORA2A (0.43) ADORA2APGK1PGK2ADORA3ADORA1
Formic Acid SCHEMBL6943622 0.85 ADORA2A (0.44) ADORA2APGK1PGK2ADORA3ADORA1
SCHEMBL6839818 0.82 ADORA2A (0.46) ADORA2APGK1PGK2ADORA3ADORA1
SCHEMBL7103495 0.79 ADORA2A (0.53) ADORA2APGK1PGK2ADORA3ADORA1
SCHEMBL7148231 0.79 ADORA2A (0.53) ADORA2APGK1PGK2ADORA3ADORA1
SCHEMBL7148224 0.79 ADORA2A (0.53) ADORA2APGK1PGK2ADORA3ADORA1
Formic Acid SCHEMBL7223577 0.76 ADORA3 (0.49) ADORA2AADORA3ADORA1ADORA2B
Formic Acid SCHEMBL7231233 0.76 ADORA3 (0.54) ADORA2AADORA3ADORA1ADORA2B
Formic Acid SCHEMBL7103623 0.76 ADORA2A (0.49) ADORA2APGK1PGK2ADORA3ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1090023-B1 2-(PURIN-9-YL)-TETRAHYDROFURAN-3,4-DIOL DERIVATIVES GLAXO GROUP LTD (GB) 2003-09-10 — — EP disclosed
EP-1090023-A1 2-(PURIN-9-YL)-TETRAHYDROFURAN-3,4-DIOL DERIVATIVES GLAXO GROUP LIMITED (GB) 2001-04-11 — — EP disclosed
WO-1999067264-A1 2-(PURIN-9-YL)-TETRAHYDROFURAN-3,4-DIOL DERIVATIVES GLAXO GROUP LIMITED (GB) 1999-12-29 — — WO disclosed