SCHEMBL30625967

CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	CALCRL	Q16602	6/20	0.55

▸	RAMP1	O60894	1/20	0.54

▸	MAPK8	P45983	1/20	0.51

▸	MAPK9	P45984	1/20	0.51

▸	MAPK10	P53779	1/20	0.51

▸	IL23R	Q5VWK5	1/20	0.50

▸	SLC6A2	P23975	1/20	0.47

▸	KEAP1	Q14145	1/20	0.44

▸	OPRM1	P35372	1/20	0.44

▸	OPRD1	P41143	1/20	0.44

▸	BDKRB2	P30411	1/20	0.43

▸	C5AR1	P21730	1/20	0.43

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
SCHEMBL30625968	0.94	MAPK8 (0.56)	CALCRLRAMP1MAPK8MAPK9MAPK10
SCHEMBL31282086	0.85	SLC6A2 (0.58)	CALCRLRAMP1MAPK8MAPK9MAPK10
SCHEMBL31232570	0.83	MAPK8 (0.59)	CALCRLRAMP1MAPK8MAPK9MAPK10
SCHEMBL30678863	0.82	NMUR2 (0.56)	SLC6A2OPRM1OPRD1
SCHEMBL31154639	0.81	OPRD1 (0.58)	MAPK8MAPK9MAPK10OPRM1OPRD1
SCHEMBL30690152	0.81	SLC6A2 (0.67)	SLC6A2OPRM1OPRD1
SCHEMBL30358199	0.80	MAPK8 (0.58)	CALCRLMAPK8MAPK9MAPK10IL23R
SCHEMBL30512590	0.80	EPHA2 (0.55)	CALCRLMAPK8MAPK9MAPK10IL23R
SCHEMBL31289578	0.80	OPRM1 (0.57)	SLC6A2OPRM1OPRD1BDKRB2
SCHEMBL9295481	0.79	NTSR1 (0.59)	OPRD1

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-113929745-B	Polypeptide for treating rhinitis and liquid composition containing polypeptide	广煜医药科技(宁夏)有限公司	2023-08-18	—	—	CN	claimed