SCHEMBL10492942

CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCSC)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	3/20	0.64

▸	CRHR1	P34998	1/20	0.61

▸	CRHR2	Q13324	1/20	0.61

▸	NPY2R	P49146	7/20	0.59

▸	NPY4R	P50391	7/20	0.59

▸	NPY5R	Q15761	7/20	0.59

▸	NPY1R	P25929	5/20	0.59

▸	KEAP1	Q14145	1/20	0.59

▸	GLP1R	P43220	6/20	0.59

▸	GCGR	P47871	5/20	0.58

▸	GIPR	P48546	5/20	0.58

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
SCHEMBL30658270	0.92	CALCR (0.71)	CALCRCRHR1CRHR2NPY2RNPY4R
SCHEMBL31182700	0.92	CALCR (0.68)	CALCRCRHR1CRHR2NPY2RNPY4R
SCHEMBL30511758	0.92	CALCR (0.58)	CALCRCRHR1CRHR2NPY2RNPY4R
SCHEMBL31182551	0.91	CALCR (0.68)	CALCRCRHR1CRHR2NPY2RNPY4R
SCHEMBL30495667	0.91	CALCR (0.67)	CALCRCRHR1CRHR2NPY2RNPY4R
SCHEMBL30495819	0.90	NPY2R (0.59)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30607293	0.90	APLNR (0.59)	CALCRKEAP1
SCHEMBL30658275	0.90	CALCR (0.71)	CALCRCRHR1CRHR2NPY2RNPY4R
SCHEMBL30431993	0.90	CALCR (0.62)	CALCRCRHR1CRHR2NPY2RNPY4R
SCHEMBL29949425	0.90	CALCR (0.67)	CALCRCRHR1CRHR2NPY2RNPY4R

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-4855231-A	Regulatory region for heterologous gene expression in yeast	PHILLIPS PETROLEUM COMPANY (US)	1989-08-08	—	—	US	disclosed
EP-0183071-A2	Regulatory region for heterologous gene expression in yeast	PHILLIPS PETROLEUM COMPANY (US)	1986-06-04	—	—	EP	disclosed