Threonine

Threonine

SCHEMBL9058511

C[C@@H](O)[C@H](N)C(=O)O.N[C@@H](Cc1ccc(OC(=O)[C@@H](N)COC(=O)[C@@H]2CCCN2)cc1)C(=O)O

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 3/20 0.36
PTPN1 P18031 1/20 0.35
DPP4 P27487 2/20 0.35
ITGB3 P05106 1/20 0.35
ITGA2B P08514 1/20 0.35
TPH1 P17752 4/20 0.34
HTR2C P28335 2/20 0.34
HTR2B P41595 1/20 0.34
FAP Q12884 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
CTSC P53634 2/20 0.33
GRB2 P62993 1/20 0.33
ALPI P09923 1/20 0.33
PKM P14618 1/20 0.33
PTGS1 P23219 1/20 0.33
XIAP P98170 1/20 0.33
REN P00797 1/20 0.32

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
Threonine SCHEMBL17728307 0.90 DPP4 (0.33) SLC7A5PTPN1DPP4ITGB3ITGA2B
Threonine SCHEMBL17728293 0.88 SLC7A5 (0.37) SLC7A5PTPN1DPP4ITGB3ITGA2B
Threonine SCHEMBL15971910 0.87 DPP4 (0.34) SLC7A5PTPN1DPP4ITGB3ITGA2B
Threonine SCHEMBL15972069 0.82 ITGB3 (0.35) ITGB3ITGA2B
SCHEMBL4542258 0.82 PTPN1 (0.45) SLC7A5PTPN1DPP4ITGB3ITGA2B
SCHEMBL8202617 0.82 DPP4 (0.33) DPP4HTR2CHTR2BCTSC
SCHEMBL17728295 0.81 HTR2C (0.36) SLC7A5PTPN1DPP4ITGB3ITGA2B
Lysine SCHEMBL17728299 0.81 ITGB3 (0.34) ITGB3ITGA2B
Phenylalanine SCHEMBL5672080 0.80 SLC7A5 (0.51) SLC7A5DPP4HTR2CHTR2BFAP
Leucine SCHEMBL3492173 0.79 SLC7A5 (0.37) SLC7A5PTPN1DPP4ITGB3ITGA2B

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-1996017074-A2 RNA POLYMERASE II PEPTIDES AND METHODS OF USE YALE UNIVERSITY (US) 1996-06-06 WO disclosed