SCHEMBL29429591

CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@H](CCCCN)C(=O)N[C@@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H](C)C(=O)N[C@H](CO)C(=O)O)C(C)C)[C@H](C)O

nearest known ligand 0.76

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	GLP1R	P43220	10/20	0.76

▸	CCKBR	P32239	1/20	0.76

▸	GCGR	P47871	1/20	0.74

▸	GIPR	P48546	1/20	0.74

▸	ECE1	P42892	1/20	0.73

▸	MUS81	Q96NY9	1/20	0.73

▸	PTH1R	Q03431	5/20	0.72

▸	RXFP1	Q9HBX9	1/20	0.69

▸	NR3C1	P04150	2/20	0.68

▸	KEAP1	Q14145	1/20	0.68

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
SCHEMBL30299221	0.96	GLP1R (0.73)	GLP1RCCKBRGCGRGIPRECE1
SCHEMBL29429571	0.96	PTH1R (0.72)	GLP1RCCKBRGCGRGIPRECE1
SCHEMBL30404098	0.96	PTH1R (0.72)	GLP1RCCKBRGCGRGIPRECE1
SCHEMBL31694503	0.96	PTH1R (0.72)	GLP1RCCKBRGCGRGIPRECE1
SCHEMBL31000919	0.95	GLP1R (0.76)	GLP1RCCKBRGCGRGIPRECE1
SCHEMBL29669652	0.94	RXFP1 (0.77)	GLP1RCCKBRGCGRGIPRECE1
SCHEMBL30773792	0.94	RXFP1 (0.77)	GLP1RCCKBRGCGRGIPRECE1
SCHEMBL30658291	0.94	GLP1R (0.73)	GLP1RCCKBRGCGRGIPRECE1
SCHEMBL30658278	0.94	GLP1R (0.77)	GLP1RCCKBRECE1MUS81NR3C1
SCHEMBL30294229	0.93	GLP1R (0.75)	GLP1RCCKBRGCGRGIPRECE1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-11634465-B2	Analogues of VDAC1-derived peptides	B. G. NEGEV TECHNOLOGIES AND APPLICATIONS LTD., AT BEN-GURION UNLVERSITY (IL)	2023-04-25	—	—	US	disclosed
CN-108350046-B	Analogs of VDAC 1-derived peptides	在本-古里安大学的B．G．内盖夫科技与应用有限公司	2022-04-01	—	—	CN	disclosed