SCHEMBL30576904

CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(C)C)[C@@H](C)O)[C@@H](C)CC

nearest known ligand 0.67

Predicted protein targets (top 18)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	5/20	0.64

▸	RAMP1	O60894	1/20	0.61

▸	RAMP2	O60895	1/20	0.61

▸	RAMP3	O60896	1/20	0.61

▸	CALCRL	Q16602	1/20	0.61

▸	KEAP1	Q14145	1/20	0.61

▸	NPY2R	P49146	7/20	0.61

▸	NPY4R	P50391	7/20	0.61

▸	NPY5R	Q15761	7/20	0.61

▸	NPY1R	P25929	5/20	0.61

▸	GLP1R	P43220	3/20	0.60

▸	CRHR1	P34998	1/20	0.60

▸	CRHR2	Q13324	1/20	0.60

▸	GCGR	P47871	1/20	0.59

▸	GIPR	P48546	1/20	0.59

▸	F2	P00734	1/20	0.59

▸	EP300	Q09472	1/20	0.59

▸	HIF1A	Q16665	1/20	0.59

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
SCHEMBL31182767	0.91	CALCR (0.67)	CALCRKEAP1NPY2RNPY4RNPY5R
SCHEMBL31182486	0.91	CALCR (0.69)	CALCRRAMP1RAMP2RAMP3CALCRL
SCHEMBL29949425	0.90	CALCR (0.67)	CALCRRAMP1RAMP2RAMP3CALCRL
SCHEMBL30511771	0.90	CALCR (0.67)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL31182755	0.90	CALCR (0.60)	CALCRRAMP1RAMP2RAMP3CALCRL
SCHEMBL30429121	0.90	MAPK8 (0.65)	CALCRKEAP1NPY2RNPY4RNPY5R
SCHEMBL30495627	0.90	NPY2R (0.64)	CALCRRAMP1RAMP2RAMP3CALCRL
SCHEMBL30721659	0.90	CALCR (0.76)	CALCRRAMP1RAMP2RAMP3CALCRL
SCHEMBL30721582	0.90	CALCR (0.76)	CALCRRAMP1RAMP2RAMP3CALCRL
SCHEMBL29649214	0.89	NPY2R (0.62)	CALCRRAMP3KEAP1NPY2RNPY4R

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-116621961-A	Gene ZmAPC4 for regulating starch content in corn kernel, expression product, SNP marker, excellent haplotype and application	河南农业大学	2023-08-22	—	—	CN	disclosed