SCHEMBL8933363

SCHEMBL8933363

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.47
ANPEP P15144 2/20 0.40
ERAP2 Q6P179 2/20 0.40
ERAP1 Q9NZ08 2/20 0.40
LAP3 P28838 1/20 0.40
ENPEP Q07075 1/20 0.40
FNTA P49354 1/20 0.39
FNTB P49356 1/20 0.39
POLB P06746 1/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
CA2 P00918 2/20 0.38
CAMK2A Q9UQM7 1/20 0.38
MME P08473 1/20 0.38
ACE P12821 1/20 0.38
FOLH1 Q04609 1/20 0.38
NAALAD2 Q9Y3Q0 1/20 0.38
CA1 P00915 1/20 0.36
PTPRC P08575 1/20 0.36
TAAR1 Q96RJ0 2/20 0.36

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
SCHEMBL8933122 1.00 SLC7A5 (0.47) SLC7A5ANPEPERAP2ERAP1LAP3
SCHEMBL9997409 0.84 SLC7A5 (0.50) SLC7A5ANPEPERAP2ERAP1LAP3
SCHEMBL7025165 0.84 SLC7A5 (0.50) SLC7A5ANPEPERAP2ERAP1LAP3
SCHEMBL169321 0.82 SLC7A5 (0.55) SLC7A5FNTAFNTBPOLBESR1
SCHEMBL169322 0.82 SLC7A5 (0.55) SLC7A5FNTAFNTBPOLBESR1
Methane SCHEMBL17267562 0.80 SLC7A5 (0.53) SLC7A5FNTAFNTBPOLBESR1
SCHEMBL6036855 0.79 SLC7A5 (0.49) SLC7A5ANPEPERAP2ERAP1LAP3
SCHEMBL15453748 0.79 SLC7A5 (0.45) SLC7A5ANPEPERAP2ERAP1LAP3
SCHEMBL15453746 0.79 SLC7A5 (0.45) SLC7A5ANPEPERAP2ERAP1LAP3
SCHEMBL23610314 0.79 SLC7A5 (0.51) SLC7A5FNTAFNTBPOLBESR1

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-1996023813-A1 PEPTIDES AND COMPOUNDS THAT BIND TO SH2 DOMAINS AFFYMAX TECHNOLOGIES N.V. (AN) 1996-08-08 WO disclosed