SCHEMBL30093029

CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	EDNRA	P25101	1/20	0.57

▸	KISS1R	Q969F8	16/20	0.54

▸	CTSB	P07858	1/20	0.52

▸	CTSK	P43235	1/20	0.52

▸	ERAP2	Q6P179	1/20	0.52

▸	MAGI3	Q5TCQ9	1/20	0.52

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
SCHEMBL30130582	0.99	EDNRA (0.57)	EDNRAKISS1RCTSBCTSKERAP2
SCHEMBL30130547	0.97	KISS1R (0.57)	EDNRAKISS1RCTSBCTSKERAP2
SCHEMBL30130555	0.97	KISS1R (0.57)	EDNRAKISS1RCTSBCTSKERAP2
SCHEMBL30092943	0.96	KISS1R (0.56)	EDNRAKISS1RCTSBCTSKERAP2
SCHEMBL30130573	0.96	EDNRA (0.59)	EDNRAKISS1RCTSBCTSKERAP2
SCHEMBL31305350	0.95	EDNRA (0.56)	EDNRAKISS1RERAP2
SCHEMBL30130527	0.95	MAGI3 (0.54)	EDNRAKISS1RCTSBCTSKMAGI3
SCHEMBL30093012	0.95	MAGI3 (0.54)	EDNRAKISS1RCTSBCTSKMAGI3
SCHEMBL30093068	0.95	MAGI3 (0.54)	EDNRAKISS1RCTSBCTSKMAGI3
SCHEMBL30533150	0.95	EDNRA (0.64)	EDNRAKISS1RCTSBCTSKERAP2

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-115397836-A	Novel antibacterial peptide and application thereof	安尼根有限公司	2022-11-25	—	—	CN	disclosed