Sugi Predict

Sugi Predict / Compounds / Formic Acid

Formic Acid

Formic Acid

SCHEMBL7202921

CCc1noc([C@H]2O[C@@H](n3cnc4c(NC(CC)CC)nc(NCCc5cn(C)cn5)nc43)[C@H](O)[C@@H]2O)n1.O=CO

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 13/20 0.47
▸ ADORA3 P0DMS8 6/20 0.47
▸ ADORA2B P29275 7/20 0.42
▸ ADORA1 P30542 3/20 0.40
▸ PGK1 P00558 3/20 0.40
▸ PGK2 P07205 3/20 0.40

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
SCHEMBL7208447 0.97 ADORA2A (0.47) ADORA2AADORA3ADORA2BADORA1PGK1
Formic Acid SCHEMBL7207900 0.93 ADORA2A (0.47) ADORA2AADORA3ADORA2BADORA1PGK1
SCHEMBL7569528 0.92 ADORA2A (0.45) ADORA2AADORA3ADORA2BADORA1PGK1
SCHEMBL7569532 0.91 ADORA2A (0.45) ADORA2AADORA3ADORA2BADORA1PGK1
Formic Acid SCHEMBL7206389 0.90 PGK1 (0.43) ADORA2AADORA3ADORA2BADORA1PGK1
SCHEMBL7204041 0.89 ADORA2A (0.48) ADORA2AADORA3ADORA2BADORA1PGK1
Formic Acid SCHEMBL7202519 0.87 ADORA2A (0.45) ADORA2AADORA3ADORA2B
SCHEMBL7204152 0.87 ADORA2A (0.47) ADORA2AADORA3ADORA2BADORA1PGK1
Formic Acid SCHEMBL7208433 0.86 ADORA2A (0.52) ADORA2AADORA3ADORA2B
SCHEMBL7206657 0.86 PGK1 (0.46) ADORA2AADORA3ADORA2BADORA1PGK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6610665-B1 Treatment of inflammatory diseases, asthma or chronic obstructive pulmonary disease SMITHKLINE BEECHAM CORPORATION 2003-08-26 — — US disclosed
EP-1056759-B1 2-(PURIN-9-YL) -TETRAHYDROFURAN-3, 4-DIOL DERIVATIVES GLAXO GROUP LTD (GB) 2002-09-04 — — EP disclosed