SCHEMBL30320509

CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](N)CC(C)C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 16)

	gene	UniProt	supporting neighbours	confidence
▸	F2	P00734	4/20	0.66

▸	CALCR	P30988	5/20	0.59

▸	CRHR1	P34998	1/20	0.58

▸	CRHR2	Q13324	1/20	0.58

▸	HCRTR1	O43613	1/20	0.55

▸	HCRTR2	O43614	1/20	0.55

▸	NTSR1	P30989	3/20	0.51

▸	NTSR2	O95665	2/20	0.51

▸	RAMP1	O60894	1/20	0.51

▸	RAMP2	O60895	1/20	0.51

▸	RAMP3	O60896	1/20	0.51

▸	CALCRL	Q16602	1/20	0.51

▸	EP300	Q09472	1/20	0.50

▸	HIF1A	Q16665	1/20	0.50

▸	NMUR2	Q9GZQ4	2/20	0.49

▸	NMUR1	Q9HB89	2/20	0.49

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
SCHEMBL30658271	0.87	CALCR (0.70)	F2CALCRCRHR1CRHR2HCRTR1
SCHEMBL30432818	0.86	F2 (0.73)	F2CALCRCRHR1CRHR2HCRTR1
SCHEMBL31174221	0.86	F2 (0.69)	F2CALCRCRHR1CRHR2HCRTR1
SCHEMBL31182962	0.86	CALCR (0.66)	F2CALCRCRHR1CRHR2HCRTR1
SCHEMBL30216268	0.85	F2 (0.67)	F2CALCRCRHR1CRHR2HCRTR1
SCHEMBL30906544	0.85	GLP1R (0.62)	F2CALCRCRHR1CRHR2
SCHEMBL29884239	0.84	CALCR (0.69)	F2CALCRCRHR1CRHR2HCRTR1
SCHEMBL30906405	0.84	GLP1R (0.62)	F2CALCR
SCHEMBL31182828	0.84	CALCR (0.71)	F2CALCRCRHR1CRHR2HCRTR1
SCHEMBL30922367	0.84	CALCR (0.72)	F2CALCRCRHR1CRHR2HCRTR1

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