Fluoride

Fluoride

SCHEMBL5897348

F.F.c1ccc(C[Sn]Cc2ccccc2)cc1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.47
TSHR P16473 4/20 0.43
ALDH1A1 P00352 3/20 0.43
IDO1 P14902 3/20 0.43
LOXL2 Q9Y4K0 2/20 0.43
TP53 P04637 1/20 0.43
TRPA1 O75762 1/20 0.43
MAOB P27338 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
ALOX12 P18054 1/20 0.41
CASP1 P29466 1/20 0.41
HSD17B10 Q99714 1/20 0.41
FAAH O00519 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
ELANE P08246 1/20 0.40
PRTN3 P24158 1/20 0.40
PRSS3 P35030 1/20 0.40
TDP1 Q9NUW8 2/20 0.39

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
SCHEMBL383933 0.97 CALM1 (0.50) CALM1TSHRALDH1A1IDO1LOXL2
Hydrochloric Acid SCHEMBL2464987 0.94 CALM1 (0.47) CALM1TSHRALDH1A1IDO1LOXL2
Bromide SCHEMBL5897404 0.94 CALM1 (0.47) CALM1TSHRALDH1A1IDO1LOXL2
Iodide SCHEMBL5898071 0.94 CALM1 (0.47) CALM1TSHRALDH1A1IDO1LOXL2
Hydrochloric Acid SCHEMBL28371010 0.94 CALM1 (0.47) CALM1TSHRALDH1A1IDO1LOXL2
Boric Acid SCHEMBL10623554 0.86 CA1 (0.46) CALM1TSHRALDH1A1IDO1LOXL2
SCHEMBL6812783 0.84 CYP1A2 (0.43) CALM1TSHRALDH1A1IDO1LOXL2
Acetic Acid SCHEMBL11563853 0.82 ALDH1A1 (0.50) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL27721048 0.80 TP53 (0.50) CALM1TSHRALDH1A1IDO1LOXL2
Fumaric Acid SCHEMBL385036 0.78 ALDH1A1 (0.53) ALDH1A1TAAR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7008899-B2 Lanthanide-based catalyst composition for producing cis-1,4-polydienes BRIDGESTONE CORPORATION (JP) 2006-03-07 US claimed
US-20050038215-A1 Lanthanide-based catalyst composition for producing cis-1,4-polydienes BRIDGESTONE CORPORATION (JP) 2005-02-17 US claimed
US-7008899-B2 Lanthanide-based catalyst composition for producing cis-1,4-polydienes BRIDGESTONE CORPORATION (JP) 2006-03-07 US disclosed
US-20050038215-A1 Lanthanide-based catalyst composition for producing cis-1,4-polydienes BRIDGESTONE CORPORATION (JP) 2005-02-17 US disclosed