SCHEMBL9724064

SCHEMBL9724064

CC(=O)N(CC(=O)O)C(=O)C(N)Cc1ccc(O)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.57
TAAR1 Q96RJ0 3/20 0.45
SLC6A2 P23975 1/20 0.45
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
ERAP2 Q6P179 1/20 0.42
LNPEP Q9UIQ6 1/20 0.42
HDAC8 Q9BY41 2/20 0.42
ALPI P09923 1/20 0.40
PKM P14618 1/20 0.40
PTGS1 P23219 1/20 0.40
XIAP P98170 1/20 0.40
YARS1 P54577 2/20 0.40
CA2 P00918 1/20 0.40
CAMK2A Q9UQM7 1/20 0.40
SLC15A1 P46059 1/20 0.39

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
SCHEMBL27375801 0.91 SLC7A5 (0.57) SLC7A5TAAR1SLC6A2ESR1ESR2
SCHEMBL8673016 0.91 SLC7A5 (0.57) SLC7A5TAAR1SLC6A2ESR1ESR2
SCHEMBL7366359 0.86 SLC7A5 (0.54) SLC7A5TAAR1SLC6A2ESR1ESR2
SCHEMBL27343864 0.86 SLC7A5 (0.54) SLC7A5TAAR1SLC6A2ESR1ESR2
SCHEMBL30440024 0.84 SLC7A5 (0.58) SLC7A5TAAR1SLC6A2ESR1ESR2
SCHEMBL4151675 0.82 SLC7A5 (0.53) SLC7A5TAAR1SLC6A2ESR1ESR2
SCHEMBL4156779 0.81 OPRM1 (0.53) SLC7A5ERAP2HDAC8ALPIPKM
SCHEMBL21067549 0.80 SIRT5 (0.53)
SCHEMBL8005620 0.79 ALPI (0.54) SLC7A5TAAR1SLC6A2ALPIPKM
SCHEMBL10435928 0.78 SLC7A5 (0.62) SLC7A5TAAR1SLC6A2ESR1ESR2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5100663-A Tyrosine-glycine dipeptide immune system stimulant useful in AIDS treatment IMREG, INC. (US) 1992-03-31 US disclosed
US-5081108-A Method of showing progression of AIDS in an ARC patient by treating with Tyr-Gly compositions IMREG, INC. (US) 1992-01-14 US disclosed