SCHEMBL30739155

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

nearest known ligand 0.52

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	ENPEP	Q07075	16/20	0.52

▸	BACE1	P56817	1/20	0.48

▸	TASP1	Q9H6P5	1/20	0.43

▸	VIPR1	P32241	1/20	0.42

▸	VIPR2	P41587	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
SCHEMBL31394924	0.97	ENPEP (0.55)	ENPEPBACE1
SCHEMBL31461989	0.92	TASP1 (0.47)	ENPEPBACE1TASP1VIPR1VIPR2
SCHEMBL31157662	0.92	ENPEP (0.52)	ENPEPBACE1
SCHEMBL29599401	0.92	ENPEP (0.53)	ENPEP
SCHEMBL31299917	0.91	ENPEP (0.53)	ENPEPBACE1TASP1VIPR1VIPR2
SCHEMBL4515920	0.91	ENPEP (0.48)	ENPEPBACE1VIPR1VIPR2
SCHEMBL4515922	0.91	ENPEP (0.48)	ENPEPBACE1VIPR1VIPR2
SCHEMBL30483975	0.91	ENPEP (0.51)	ENPEP
SCHEMBL30483972	0.90	ENPEP (0.49)	ENPEPBACE1TASP1VIPR1VIPR2
SCHEMBL30010354	0.90	ENPEP (0.50)	ENPEPBACE1VIPR1VIPR2

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-117343980-A	Screening method of hemp seed polypeptide sequence with antithrombotic activity	黑龙江省科学院大庆分院	2024-01-05	—	—	CN	disclosed