SCHEMBL11450544

SCHEMBL11450544

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

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 3/20 0.71
▸ PTGS1 P23219 3/20 0.70
▸ ALPI P09923 1/20 0.70
▸ PKM P14618 1/20 0.70
▸ XIAP P98170 1/20 0.70
▸ HIF1A Q16665 5/20 0.59
▸ ALOX15 P16050 3/20 0.59
▸ KDM4E B2RXH2 2/20 0.59
▸ TDP1 Q9NUW8 2/20 0.59
▸ HSD17B10 Q99714 2/20 0.59
▸ USP2 O75604 1/20 0.59
▸ EGFR P00533 1/20 0.59
▸ LCK P06239 1/20 0.59
▸ FYN P06241 1/20 0.59
▸ ADORA3 P0DMS8 1/20 0.59
▸ HTR2A P28223 1/20 0.59
▸ PTGS2 P35354 1/20 0.59
▸ RECQL P46063 1/20 0.59
▸ TPH1 P17752 1/20 0.59
▸ GRB2 P62993 1/20 0.59

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
SCHEMBL341978 1.00 SLC7A5 (0.71) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL27800519 1.00 SLC7A5 (0.71) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL2310526 0.91 SLC7A5 (0.83) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL16581271 0.85 SLC7A5 (0.74) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL837014 0.85 SLC7A5 (0.74) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL156189 0.85 SLC7A5 (0.74) SLC7A5PTGS1ALPIPKMXIAP
Tyrosine SCHEMBL11520027 0.83 SLC7A5 (1.00) SLC7A5PTGS1ALPIPKMXIAP
Tyrosine SCHEMBL11520041 0.83 SLC7A5 (1.00) SLC7A5PTGS1ALPIPKMXIAP
Tyrosine SCHEMBL638520 0.83 SLC7A5 (1.00) SLC7A5PTGS1ALPIPKMXIAP
Tyrosine SCHEMBL20787 0.83 SLC7A5 (1.00) SLC7A5PTGS1ALPIPKMXIAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101948434-A Chiral tyrosine radical ionic liquid IRICO GROUP CORP 2011-01-19 — — CN disclosed
CN-101948434-A Chiral tyrosine radical ionic liquid IRICO GROUP CORP 2011-01-19 — — CN disclosed
US-4238481-A HYPOGLYCEMIC AGENT; HYPERGLYCEMIC AGENT; ANIMAL GROWTH REGULATOR CIBA-GEIGY CORPORATION (US) 1980-12-09 — — US disclosed
US-3793304-A CYCLIC DECAPEPTIDES COMPRISING AN L-TYROSINE RADICAL BOEHRINGER SOHN INGELHEIM 1974-02-19 — — US disclosed
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