SCHEMBL30932611

C[C@H](N)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	EPHA2	P29317	6/20	0.59

▸	NMUR2	Q9GZQ4	5/20	0.55

▸	NMUR1	Q9HB89	5/20	0.55

▸	OPRM1	P35372	7/20	0.53

▸	OPRD1	P41143	1/20	0.53

▸	OPRK1	P41145	6/20	0.53

▸	CXCR4	P61073	1/20	0.51

▸	MAPK8	P45983	1/20	0.50

▸	MAPK9	P45984	1/20	0.50

▸	MAPK10	P53779	1/20	0.50

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
SCHEMBL31356488	0.96	EPHA2 (0.58)	EPHA2NMUR2NMUR1OPRM1OPRD1
SCHEMBL30003633	0.95	EPHA2 (0.59)	EPHA2NMUR2NMUR1OPRM1OPRD1
SCHEMBL29474446	0.94	EPHA2 (0.57)	EPHA2NMUR2NMUR1OPRM1OPRD1
SCHEMBL31741322	0.92	EPHA2 (0.66)	EPHA2NMUR2NMUR1OPRM1OPRD1
SCHEMBL29474445	0.92	RAMP3 (0.50)	EPHA2NMUR2NMUR1CXCR4
SCHEMBL31674471	0.87	EPHA2 (0.62)	EPHA2OPRM1OPRK1CXCR4
SCHEMBL30733269	0.86	EPHA2 (0.55)	EPHA2NMUR2NMUR1OPRM1OPRD1
SCHEMBL31674472	0.86	EPHA2 (0.61)	EPHA2OPRM1OPRK1CXCR4
SCHEMBL31019921	0.85	EPHA2 (0.59)	EPHA2NMUR2NMUR1OPRM1OPRD1
SCHEMBL29777377	0.85	NMUR2 (0.56)	EPHA2NMUR2NMUR1OPRM1OPRK1

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-118184736-A	Active peptide, composition containing active peptide and application thereof	中国科学院过程工程研究所	2024-06-14	—	—	CN	disclosed