SCHEMBL28549604

SCHEMBL28549604

O=C(O)F.O=C(O)F.O=C(O)F.O=C(O)F.O=C(O)F.O=C(O)F.O=C(O)F.O=C(O)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
FFAR3 O14843 2/20 0.40
ACHE P22303 1/20 0.40
LCK P06239 1/20 0.40
FYN P06241 1/20 0.40
TSHR P16473 5/20 0.33
LDHA P00338 2/20 0.33
EGLN1 Q9GZT9 2/20 0.33
LDHB P07195 1/20 0.33
SRR Q9GZT4 1/20 0.33
TP53 P04637 1/20 0.33
LMNA P02545 1/20 0.33
ALKBH5 Q6P6C2 1/20 0.33
SUCNR1 Q9BXA5 1/20 0.33
EGLN3 Q9H6Z9 1/20 0.33
GABRR1 P24046 1/20 0.32
GLRA1 P23415 1/20 0.31
SLC6A9 P48067 1/20 0.31

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
SCHEMBL16447961 1.00 CA1 (0.50) CA1CA2CA9FFAR3ACHE
SCHEMBL9561416 1.00 CA1 (0.50) CA1CA2CA9FFAR3ACHE
SCHEMBL17187955 1.00
SCHEMBL2536329 1.00 CA1 (0.50) CA1CA2CA9FFAR3ACHE
SCHEMBL34222 1.00
Bromide SCHEMBL9097149 0.94
Fluoride SCHEMBL728145 0.94
SCHEMBL9850690 0.94
SCHEMBL1066607 0.94 CA1 (0.44) CA1CA2CA9FFAR3ACHE
SCHEMBL9902050 0.94

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-112546244-A Fibroblast growth factor receptor2 specific peptide reagents and methods 密执安州立大学董事会 2021-03-26 CN disclosed