Triphenylphosphine Oxide

Triphenylphosphine Oxide

SCHEMBL8328973

O=P(c1ccccc1)(c1ccccc1)c1ccccc1.O=S(=O)(O)O

nearest known ligand 0.52

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Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Triphenylphosphine Oxide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.52
CA4 P22748 1/20 0.52
CA5A P35218 1/20 0.52
LMNA P02545 1/20 0.47
CFTR P13569 1/20 0.46
TSHR P16473 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KMT2A Q03164 3/20 0.46
POLB P06746 2/20 0.46
APOBEC3A P31941 1/20 0.46
CASP6 P55212 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46
MEN1 O00255 2/20 0.44
GAA P10253 2/20 0.43
ALOX15 P16050 1/20 0.43
USP2 O75604 1/20 0.43
ESR1 P03372 1/20 0.43
ALDH1A1 P00352 3/20 0.41
NPSR1 Q6W5P4 2/20 0.40

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
Triphenylphosphine Oxide SCHEMBL8431251 0.89 CA2 (0.63) CA2CA4CA5ALMNACFTR
Triphenylphosphine Oxide SCHEMBL8431247 0.89 CA2 (0.63) CA2CA4CA5ALMNACFTR
Triphenylphosphine Oxide SCHEMBL513223 0.86 CA2 (0.58) CA2CA4CA5ALMNACFTR
Triphenylphosphine Oxide SCHEMBL3949 0.86 CA2 (0.58) CA2CA4CA5ALMNACFTR
Triphenylphosphine Oxide SCHEMBL27645835 0.83 CA2 (0.65) CA2CA4CA5ALMNACFTR
SCHEMBL132983 0.83 LMNA (0.60) CA2CA4CA5ALMNACFTR
Triphenylphosphine Oxide SCHEMBL3753871 0.83 CA2 (0.55) CA2CA4CA5ALMNACFTR
SCHEMBL5439069 0.83 LMNA (0.60) CA2CA4CA5ALMNACFTR
Triphenylphosphine Oxide SCHEMBL7551485 0.83 CA2 (0.55) CA2CA4CA5ALMNACFTR
Triphenylphosphine Oxide SCHEMBL11214761 0.83 CA2 (0.55) CA2CA4CA5ALMNACFTR

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
US-5892121-A Purification of tertiary phosphine oxides BASF AKTIENGESELLSCHAFT (DE) 1999-04-06 US disclosed