Formic Acid

Formic Acid

SCHEMBL7566394

CCC(CC)Nc1nc(N(CO)CCc2ccccc2)nc2c1ncn2[C@@H]1O[C@H](c2nc(C)no2)[C@@H](O)[C@H]1O.O=CO

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 5/20 0.45
ADORA2B P29275 5/20 0.45
ADORA1 P30542 2/20 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
SCHEMBL7207963 0.97 ADORA2A (0.44) ADORA2AADORA2BADORA1
SCHEMBL7566399 0.92 ADORA2A (0.41) ADORA2AADORA2BADORA1
Formic Acid SCHEMBL7208762 0.89 ADORA2A (0.43) ADORA2AADORA2B
Formic Acid SCHEMBL7595821 0.88 ADORA2A (0.44) ADORA2AADORA2BADORA1
Formic Acid SCHEMBL7202947 0.87 ADORA3 (0.47) ADORA2AADORA2BADORA1
SCHEMBL7207666 0.85 ADORA2A (0.42) ADORA2AADORA2BADORA1
SCHEMBL6841624 0.84 ADORA2A (0.43) ADORA2AADORA2BADORA1
SCHEMBL7203734 0.83 ADORA3 (0.50) ADORA2AADORA2BADORA1
SCHEMBL7208768 0.81 ADORA2A (0.40) ADORA2AADORA2B
Formic Acid SCHEMBL7567103 0.80 ADORA3 (0.48) ADORA2AADORA2BADORA1

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
EP-1056759-B1 2-(PURIN-9-YL) -TETRAHYDROFURAN-3, 4-DIOL DERIVATIVES GLAXO GROUP LTD (GB) 2002-09-04 EP disclosed