SCHEMBL28028382

SCHEMBL28028382

C=C(C)CC(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FDPS P14324 7/20 0.44
LAP3 P28838 2/20 0.39
PGK1 P00558 1/20 0.38
PGK2 P07205 1/20 0.38
BTN3A1 O00481 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MMP2 P08253 1/20 0.32
THRB P10828 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GGPS1 O95749 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
SCHEMBL6899520 0.75 FDPS (0.52) FDPSLAP3PGK1PGK2BTN3A1
SCHEMBL19211960 0.74 FDPS (0.39) FDPSLAP3PGK1PGK2KDM4E
SCHEMBL4823060 0.73 LAP3 (0.44) FDPSLAP3PGK1PGK2BTN3A1
SCHEMBL300621 0.69
Phosphoric Acid SCHEMBL5964095 0.69 LAP3 (0.39) FDPSLAP3BTN3A1MMP2
SCHEMBL28909662 0.67
SCHEMBL28909676 0.67 HSD17B10 (0.31) HSD17B10
SCHEMBL2545055 0.67 FOLH1 (0.52) FDPS
Phosphoric Acid SCHEMBL3211434 0.65 LAP3 (0.39) FDPSLAP3PGK1PGK2BTN3A1
Phosphoric Acid SCHEMBL3215377 0.65 LAP3 (0.39) FDPSLAP3PGK1PGK2BTN3A1

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-104762275-A Enzyme with function of catalyzing DMA to synthesize DMAPP and application thereof TIANJIN INST IND BIOTECHNOLOGY CAS 2015-07-08 CN disclosed