Phosphine

Phosphine

SCHEMBL28056813

O=C1C=CC(=O)N1.O=C1C=CC(=O)N1C1=Cc2ccccc21.P

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 13/20 0.38
TLR9 Q9NR96 1/20 0.37
GSK3B P49841 2/20 0.35
GSK3A P49840 1/20 0.35
CCR6 P51684 1/20 0.35
FAAH O00519 3/20 0.33
HSP90AA1 P07900 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
BCHE P06276 1/20 0.31
POLB P06746 1/20 0.31
PTPRC P08575 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
PKM P14618 1/20 0.31
IDO1 P14902 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 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
SCHEMBL735013 0.88 TLR9 (0.46) MGLLTLR9FAAHHSP90AA1KDM4E
SCHEMBL9342908 0.73 MEN1 (0.45) MEN1ALDH1A1POLBKMT2A
SCHEMBL3858990 0.70 MGLL (0.75) MGLLTLR9GSK3BGSK3ACCR6
SCHEMBL5048603 0.68 GSK3B (0.61) GSK3BGSK3ACCR6KDM4EMEN1
SCHEMBL10783521 0.68 GSK3B (0.61) GSK3BGSK3ACCR6KDM4EMEN1
SCHEMBL9324699 0.65 MAPT (0.44) MGLLCCR6HSP90AA1ALDH1A1LMNA
SCHEMBL9870942 0.63 MGLL (0.77) MGLLCCR6FAAHHSP90AA1MAPT
SCHEMBL28846213 0.62
SCHEMBL9723881 0.61 MGLL (0.37) MGLLTLR9GSK3BGSK3ACCR6
Naphthalene SCHEMBL20917793 0.61 GSK3B (0.65) GSK3BGSK3ACCR6HSP90AA1KDM4E

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-105742639-A Battery electrode paste composition 财团法人工业技术研究院 2016-07-06 CN disclosed