Barbituric Acid

Barbituric Acid

SCHEMBL9501277

C=C(C)C(=O)O.C=C(C)C(=O)O.O=C1CC(=O)NC(=O)N1

nearest known ligand 0.40

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Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 1/20 0.40
ITGB1 P05556 1/20 0.40
ITGAV P06756 1/20 0.40
ITGA4 P13612 1/20 0.40
HSD17B10 Q99714 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
HPGD P15428 1/20 0.39
HIF1A Q16665 1/20 0.39
USP2 O75604 1/20 0.33
SRC P12931 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
CRBN Q96SW2 1/20 0.30
TDP2 O95551 1/20 0.30

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
Barbituric Acid SCHEMBL27465421 0.88 ITGB3 (0.44) ITGB3ITGB1ITGAVITGA4HSD17B10
Thiobarbituric SCHEMBL10942405 0.87 ITGB3 (0.38) ITGB3ITGB1ITGAVITGA4SRC
Barbituric Acid SCHEMBL27510373 0.83 ITGB3 (0.48) ITGB3ITGB1ITGAVITGA4HSD17B10
Barbituric Acid SCHEMBL1470199 0.83 HSD17B10 (0.50) ITGB3ITGB1ITGAVITGA4HSD17B10
Hydantoin SCHEMBL30023441 0.81 CRBN (0.35) USP2CRBN
Methacrylic Acid SCHEMBL5431596 0.81 ITGB3 (0.36) ITGB3ITGB1ITGAVITGA4TDP2
Methacrylic Acid SCHEMBL28101220 0.79 ITGB3 (0.35) ITGB3ITGB1ITGAVITGA4TDP2
Succinimide SCHEMBL73277 0.79 CRBN (0.52) ITGB3ITGB1ITGAVITGA4ALDH1A1
Barbituric Acid SCHEMBL38707 0.77
Barbituric Acid SCHEMBL9941322 0.77

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
US-5256784-A Merocyanine dyes MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-10-26 US disclosed