SCHEMBL29669652

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

nearest known ligand 0.77

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	RXFP1	Q9HBX9	4/20	0.77

▸	GLP1R	P43220	10/20	0.76

▸	CCKBR	P32239	1/20	0.76

▸	PTH1R	Q03431	3/20	0.72

▸	GCGR	P47871	1/20	0.71

▸	GIPR	P48546	1/20	0.71

▸	ECE1	P42892	1/20	0.71

▸	MUS81	Q96NY9	1/20	0.71

▸	IL23R	Q5VWK5	1/20	0.68

▸	NR3C1	P04150	2/20	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
SCHEMBL30773792	1.00	RXFP1 (0.77)	RXFP1GLP1RCCKBRPTH1RGCGR
SCHEMBL29429436	0.95	GLP1R (0.78)	RXFP1GLP1RCCKBRGCGRGIPR
SCHEMBL29683237	0.95	GLP1R (0.78)	RXFP1GLP1RCCKBRGCGRGIPR
SCHEMBL29429591	0.94	GLP1R (0.76)	RXFP1GLP1RCCKBRPTH1RGCGR
SCHEMBL30658278	0.93	GLP1R (0.77)	GLP1RCCKBRECE1MUS81NR3C1
SCHEMBL29634677	0.93	GLP1R (0.77)	GLP1RCCKBRECE1MUS81NR3C1
SCHEMBL30721601	0.93	GLP1R (0.77)	GLP1RCCKBRECE1MUS81NR3C1
SCHEMBL29498823	0.93	GLP1R (0.77)	GLP1RCCKBRECE1MUS81NR3C1
SCHEMBL30658238	0.92	GLP1R (0.73)	GLP1RCCKBRECE1MUS81
SCHEMBL31000919	0.92	GLP1R (0.76)	RXFP1GLP1RCCKBRPTH1RGCGR

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-114641486-A	For reducing CB1Peptide compounds of side effects of receptor agonists	庞培法布拉大学	2022-06-17	—	—	CN	disclosed