Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL30045679

NCCCC(=O)Nc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O.O=C(O)C(F)(F)F

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 12/20 0.55
▸ BRD4 O60885 7/20 0.53
▸ IKZF1 Q13422 2/20 0.52
▸ TNF P01375 1/20 0.52
▸ IL1B P01584 1/20 0.52
▸ DDB1 Q16531 1/20 0.52
▸ IKZF3 Q9UKT9 1/20 0.52
▸ HDAC3 O15379 1/20 0.51
▸ HDAC1 Q13547 1/20 0.51
▸ CSNK1A1 P48729 1/20 0.50
▸ MAP1LC3B Q9GZQ8 4/20 0.49

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
Trifluoroacetic Acid SCHEMBL17873758 0.97 CRBN (0.54) CRBNBRD4IKZF1TNFIL1B
Trifluoroacetic Acid SCHEMBL29922473 0.97 CRBN (0.54) CRBNBRD4IKZF1TNFIL1B
Trifluoroacetic Acid SCHEMBL17873750 0.97 CRBN (0.54) CRBNBRD4IKZF1TNFIL1B
Trifluoroacetic Acid SCHEMBL17873763 0.97 CRBN (0.54) CRBNBRD4IKZF1TNFIL1B
Trifluoroacetic Acid SCHEMBL29922142 0.97 CRBN (0.54) CRBNBRD4IKZF1TNFIL1B
Trifluoroacetic Acid SCHEMBL29922014 0.97 CRBN (0.54) CRBNBRD4IKZF1TNFIL1B
SCHEMBL20933080 0.94 CRBN (0.60) CRBNBRD4IKZF1TNFIL1B
SCHEMBL17873802 0.91 CRBN (0.59) CRBNBRD4IKZF1TNFIL1B
SCHEMBL17873770 0.91 CRBN (0.58) CRBNBRD4IKZF1TNFIL1B
SCHEMBL31526908 0.91 CRBN (0.58) CRBNBRD4IKZF1TNFIL1B

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
CN-115433257-A Imidazopyridazine bifunctional PROTAC molecular compound and preparation and application thereof 广西大学 2022-12-06 — — CN disclosed
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