Tribromoacetic Acid

Tribromoacetic Acid

SCHEMBL11512302

NC1=NCCS1.O=C(O)C(Br)(Br)Br

nearest known ligand 0.61

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Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 2/20 0.61
NOS1 P29475 2/20 0.61
NOS2 P35228 2/20 0.61
NPC1 O15118 5/20 0.36
RAB9A P51151 4/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
TP53 P04637 1/20 0.36
KMT2A Q03164 4/20 0.33
MAPT P10636 4/20 0.33
ALDH1A1 P00352 4/20 0.33
MEN1 O00255 3/20 0.33
GAA P10253 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TOP1 P11387 1/20 0.32

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
Trichloroacetic Acid SCHEMBL11153895 0.85 NOS3 (0.61) NOS3NOS1NOS2NPC1RAB9A
Acetic Acid SCHEMBL5037744 0.82 NOS3 (0.70) NOS3NOS1NOS2NPC1RAB9A
Formic Acid SCHEMBL27456030 0.75
Trimethylammonium SCHEMBL27589215 0.72 NOS3 (0.84) NOS3NOS1NOS2SMN1; SMN2KMT2A
SCHEMBL11512136 0.72 NOS3 (0.53) NOS3NOS1NOS2NPC1RAB9A
Aminothiazole SCHEMBL27579629 0.65 NOS2 (0.61) NOS3NOS1NOS2ALDH1A1HSD17B10
SCHEMBL3208153 0.64
Tribromoacetic Acid SCHEMBL210187 0.62
Tribromoacetic Acid SCHEMBL1331874 0.62
SCHEMBL3530804 0.61

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-4133687-A Photographic elements having hydrophilic colloid layers containing compounds having activator precursors and hydrophobic developing agents uniformly loaded in latex polymer particles EASTMAN KODAK COMPANY (US) 1979-01-09 US disclosed
US-4012260-A THIAZOLINIUM COMPOUNDS EASTMAN KODAK COMPANY (US) 1977-03-15 US disclosed