SCHEMBL29837349

CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	TFPI	P10646	1/20	0.46

▸	BACE1	P56817	3/20	0.45

▸	TASP1	Q9H6P5	1/20	0.45

▸	NPY4R	P50391	8/20	0.44

▸	NPY1R	P25929	6/20	0.44

▸	NPY2R	P49146	4/20	0.44

▸	NPY5R	Q15761	4/20	0.44

▸	VIPR1	P32241	1/20	0.43

▸	BACE2	Q9Y5Z0	1/20	0.42

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
SCHEMBL29837350	0.99	TFPI (0.47)	TFPIBACE1TASP1NPY4RNPY1R
SCHEMBL30692435	0.97	TFPI (0.47)	TFPIBACE1TASP1NPY4RNPY1R
SCHEMBL30262050	0.94	TFPI (0.50)	TFPIBACE1VIPR1BACE2
SCHEMBL29625167	0.91	NPY4R (0.49)	TFPIBACE1NPY4RNPY1RNPY2R
SCHEMBL30578960	0.91	BACE1 (0.45)	BACE1NPY4RNPY1RNPY2RNPY5R
SCHEMBL31461989	0.90	TASP1 (0.47)	BACE1TASP1VIPR1
SCHEMBL29696019	0.90	NPY4R (0.49)	TFPIBACE1NPY4RNPY1RNPY2R
SCHEMBL29374977	0.89	NPY4R (0.41)	BACE1NPY4RNPY1RNPY2RNPY5R
SCHEMBL30839890	0.89	NPY4R (0.42)	BACE1NPY4RNPY1RNPY2RNPY5R
SCHEMBL31211761	0.89	NPY4R (0.47)	BACE1NPY4RNPY1RNPY2RNPY5R

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-115124608-A	Barley-derived self-assembly peptide and preparation method and application thereof	上海理工大学	2022-09-30	—	—	CN	disclosed