SCHEMBL30320583

CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(C)C)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	RAMP3	O60896	15/20	0.52

▸	CALCR	P30988	15/20	0.52

▸	EPHA2	P29317	2/20	0.49

▸	CAPN1	P07384	2/20	0.48

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
SCHEMBL31410874	0.90	RAMP3 (0.53)	RAMP3CALCRCAPN1
SCHEMBL31307235	0.90	RAMP3 (0.57)	RAMP3CALCREPHA2CAPN1
SCHEMBL30799203	0.89	MAPK8 (0.49)	RAMP3CALCRCAPN1
SCHEMBL29655740	0.89	MAPK8 (0.51)	RAMP3CALCREPHA2
SCHEMBL29636364	0.89	EPHA2 (0.51)	RAMP3CALCREPHA2
SCHEMBL29636362	0.89	EPHA2 (0.51)	RAMP3CALCREPHA2
SCHEMBL30432923	0.88	RAMP3 (0.53)	RAMP3CALCRCAPN1
SCHEMBL30864216	0.88	RAMP3 (0.56)	RAMP3CALCR
SCHEMBL31313242	0.87	EPHA2 (0.52)	RAMP3CALCREPHA2
SCHEMBL31307270	0.87	RAMP3 (0.54)	RAMP3CALCR

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-111269289-B	Tumor cell affinity peptide separated from venenum bufonis and screening method thereof	南京中医药大学	2023-04-18	—	—	CN	disclosed