Fluoride

Fluoride

SCHEMBL28879249

F.O=C(O)C(O)c1ccc(F)cc1

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.60
MAPK1 P28482 1/20 0.60
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45
HDAC5 Q9UQL6 1/20 0.45
NPSR1 Q6W5P4 2/20 0.42
BLM P54132 1/20 0.42
TSHR P16473 1/20 0.42
MME P08473 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL4632807 0.98 LMNA (0.62) LMNAMAPK1HDAC3HDAC4HDAC1
SCHEMBL196919 0.98 LMNA (0.62) LMNAMAPK1HDAC3HDAC4HDAC1
SCHEMBL196920 0.98 LMNA (0.62) LMNAMAPK1HDAC3HDAC4HDAC1
SCHEMBL8997409 0.91 LMNA (0.56) LMNAMAPK1HDAC3HDAC4HDAC1
SCHEMBL275597 0.85 LMNA (0.79) LMNAMAPK1NPSR1BLMTSHR
SCHEMBL19735013 0.77 HDAC3 (0.45) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL11218186 0.77 HDAC3 (0.45) LMNAMAPK1HDAC3HDAC4HDAC1
SCHEMBL4092644 0.77 HDAC3 (0.45) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL531658 0.77 HDAC3 (0.45) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL1957930 0.76 LMNA (0.65) LMNAMAPK1NPSR1BLMTSHR

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-110382494-A Substituted pyrazolo [1,5-A ] pyridine compounds as RET kinase inhibitors 阿雷生物药品公司 2019-10-25 CN disclosed