Phenylalanine Methyl Ester

SCHEMBL28118728

COC(=O)C(N)Cc1ccccc1.O=C(O)C(Cc1ccc(O)cc1)NCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	SLC7A5	Q01650	1/20	0.50

▸	ATM	Q13315	2/20	0.49

▸	TSHR	P16473	1/20	0.48

▸	MDM4	O15151	1/20	0.48

▸	MDM2	Q00987	1/20	0.48

▸	L3MBTL1	Q9Y468	1/20	0.47

▸	LNPEP	Q9UIQ6	4/20	0.47

▸	ERAP2	Q6P179	3/20	0.47

▸	ERAP1	Q9NZ08	2/20	0.47

▸	TRPM8	Q7Z2W7	1/20	0.46

▸	MME	P08473	1/20	0.46

▸	OPRD1	P41143	2/20	0.46

▸	OPRM1	P35372	1/20	0.46

▸	OPRK1	P41145	1/20	0.46

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.

Compound	similarity	top predicted	shared targets
Dl-Phenylalanine SCHEMBL28118724	0.89	SLC7A5 (0.65)	SLC7A5MMEOPRD1OPRM1OPRK1
SCHEMBL7260951	0.87	ATM (0.62)	ATMTSHRMDM4MDM2L3MBTL1
Phenylalanine Methyl Ester SCHEMBL28119139	0.86	SLC7A5 (0.69)	SLC7A5TSHRMDM4MDM2
SCHEMBL121371	0.86	MME (0.58)	SLC7A5MME
SCHEMBL6716497	0.86	MME (0.58)	SLC7A5MME
SCHEMBL121370	0.86	MME (0.58)	SLC7A5MME
SCHEMBL11346818	0.86	MME (0.58)	SLC7A5MME
SCHEMBL6065430	0.86	MME (0.58)	SLC7A5MME
Tyrosine Methyl Ester SCHEMBL27550349	0.82	MIF (0.54)	SLC7A5TSHRMDM4MDM2LNPEP
SCHEMBL2375646	0.82	ATM (0.68)	ATML3MBTL1TRPM8

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-106188231-A	The synthesis of pasireotide pentapeptide intermediate and application	中国医学科学院药物研究所	2016-12-07	—	—	CN	disclosed