SCHEMBL29903316

CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CS)C(C)C)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	7/20	0.64

▸	NPY4R	P50391	7/20	0.64

▸	NPY5R	Q15761	7/20	0.64

▸	NPY1R	P25929	5/20	0.64

▸	KDM1A	O60341	3/20	0.64

▸	MAOB	P27338	1/20	0.62

▸	KDM5A	P29375	1/20	0.62

▸	KDM1B	Q8NB78	1/20	0.62

▸	TFPI	P10646	6/20	0.62

▸	EPHA2	P29317	2/20	0.61

▸	CXCR4	P61073	1/20	0.58

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
SCHEMBL30924728	0.91	EPHA2 (0.65)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL30824301	0.91	NPY2R (0.63)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL30335912	0.91	NPY2R (0.60)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL29695639	0.91	TFPI (0.62)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL31031455	0.90	KDM1A (0.65)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL30432704	0.90	NPY2R (0.68)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL30880900	0.90	MAPK8 (0.60)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL29856103	0.89	TFPI (0.60)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL30435649	0.89	NPY2R (0.68)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL30607456	0.89	NPY2R (0.70)	NPY2RNPY4RNPY5RNPY1RKDM1A

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-107325188-B	Construction method and application of CHO cell strain of porcine serum protein fused with porcine circovirus Cap2 protein	唐山怡安生物工程有限公司	2022-08-23	—	—	CN	disclosed