Phosphonodifluoromethyl Phenylalanine

Phosphonodifluoromethyl Phenylalanine

SCHEMBL9545904

N[C@H](Cc1ccc(C(F)(F)P(=O)(O)O)cc1)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

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Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 12/20 1.00
GRB2 P62993 1/20 0.66
SLC7A5 Q01650 2/20 0.57
ALPI P09923 1/20 0.57
PKM P14618 1/20 0.57
PTGS1 P23219 1/20 0.57
XIAP P98170 1/20 0.57
PTPN2 P17706 4/20 0.55
PTPN6 P29350 4/20 0.55
PTPN11 Q06124 3/20 0.55
PGK1 P00558 2/20 0.55
PGK2 P07205 2/20 0.55
PTPRC P08575 2/20 0.55
PTPN5 P54829 1/20 0.50
PTPRB P23467 1/20 0.50
CDC25A P30304 1/20 0.50
PTPRA P18433 1/20 0.49

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
Phosphonodifluoromethyl Phenylalanine SCHEMBL2517439 1.00 PTPN1 (1.00) PTPN1GRB2SLC7A5ALPIPKM
Phosphonodifluoromethyl Phenylalanine SCHEMBL2517440 1.00 PTPN1 (1.00) PTPN1GRB2SLC7A5ALPIPKM
SCHEMBL27715838 0.88 PTPN1 (0.78) PTPN1GRB2PTPN2PTPN6PTPN11
SCHEMBL13997109 0.87 PTPN1 (0.76) PTPN1GRB2SLC7A5ALPIPKM
SCHEMBL7831965 0.86 PTPN1 (0.75) PTPN1PTPN2PTPN6PTPN11PGK1
SCHEMBL43861 0.82 GRB2 (0.76) PTPN1GRB2SLC7A5ALPIPKM
SCHEMBL148122 0.82 GRB2 (0.76) PTPN1GRB2SLC7A5ALPIPKM
SCHEMBL43862 0.82 GRB2 (0.76) PTPN1GRB2SLC7A5ALPIPKM
Dl-Phenylalanine SCHEMBL28313877 0.81 SLC7A5 (0.71) PTPN1GRB2SLC7A5ALPIPKM
SCHEMBL2423462 0.81 PTPN1 (0.67) PTPN1GRB2SLC7A5ALPIPKM

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
WO-1993025561-A1 PHOSPHONOALKYL PHENYLALANINE COMPOUNDS SUITABLY PROTECTED FOR USE IN PEPTIDE SYNTHESIS THE GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1993-12-23 WO claimed