Fluoride

Fluoride

SCHEMBL28089840

COc1ccccc1N=Nc1ccccc1.F

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.57
MEN1 O00255 8/20 0.57
MAPT P10636 9/20 0.49
ALDH1A1 P00352 5/20 0.49
L3MBTL1 Q9Y468 4/20 0.49
MAPK1 P28482 3/20 0.49
TDP1 Q9NUW8 3/20 0.49
NPSR1 Q6W5P4 2/20 0.49
LMNA P02545 2/20 0.49
OPRK1 P41145 1/20 0.49
HTT P42858 1/20 0.49
MMP14 P50281 1/20 0.49
GPR55 Q9Y2T6 1/20 0.49
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA4 P22748 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46

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
SCHEMBL1405267 0.98 KMT2A (0.58) KMT2AMEN1MAPTALDH1A1L3MBTL1
SCHEMBL31071661 0.98 KMT2A (0.58) KMT2AMEN1MAPTALDH1A1L3MBTL1
SCHEMBL1405268 0.98 KMT2A (0.58) KMT2AMEN1MAPTALDH1A1L3MBTL1
Dioxane SCHEMBL26187555 0.91 KMT2A (0.50) KMT2AMEN1MAPTALDH1A1L3MBTL1
SCHEMBL1405477 0.87 CA1 (0.60) KMT2AMEN1MAPTALDH1A1L3MBTL1
SCHEMBL1405475 0.87 CA1 (0.60) KMT2AMEN1MAPTALDH1A1L3MBTL1
SCHEMBL23246462 0.83 KMT2A (0.45) KMT2AMEN1MAPTALDH1A1L3MBTL1
SCHEMBL11145990 0.83 KMT2A (0.56) KMT2AMEN1MAPTALDH1A1L3MBTL1
SCHEMBL29926116 0.83 KMT2A (0.56) KMT2AMEN1MAPTALDH1A1L3MBTL1
SCHEMBL10568642 0.83 KMT2A (0.65) KMT2AMEN1MAPTALDH1A1L3MBTL1

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-105971126-A Anti-rust type connecting device for modular building 江苏博开达工业化住宅制造有限公司 2016-09-28 CN claimed