SCHEMBL8429833

C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	CXCL8	P10145	10/20	0.46

▸	RAMP3	O60896	4/20	0.44

▸	CALCR	P30988	4/20	0.44

▸	BDKRB2	P30411	1/20	0.43

▸	EPHA2	P29317	2/20	0.42

▸	KEAP1	Q14145	1/20	0.41

▸	NPY1R	P25929	1/20	0.40

▸	NPY2R	P49146	1/20	0.40

▸	NPY4R	P50391	1/20	0.40

▸	NPY5R	Q15761	1/20	0.40

▸	GRB2	P62993	1/20	0.40

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
SCHEMBL8431318	0.98	CXCL8 (0.45)	CXCL8RAMP3CALCRBDKRB2EPHA2
SCHEMBL8429429	0.95	CXCL8 (0.46)	CXCL8RAMP3CALCRBDKRB2EPHA2
SCHEMBL8427600	0.90	BDKRB2 (0.43)	CXCL8BDKRB2KEAP1GRB2
SCHEMBL29546551	0.85	GRB2 (0.48)	CXCL8RAMP3CALCRGRB2
SCHEMBL29547288	0.85	GRB2 (0.48)	CXCL8RAMP3CALCRGRB2
SCHEMBL31307226	0.84	RAMP3 (0.47)	CXCL8RAMP3CALCRNPY1RNPY2R
SCHEMBL8429835	0.83	NMUR2 (0.54)	CXCL8
SCHEMBL29827592	0.80	RAMP3 (0.53)	RAMP3CALCRKEAP1
SCHEMBL29596671	0.80	GRB2 (0.48)	RAMP3CALCRBDKRB2KEAP1GRB2
SCHEMBL30401046	0.80	RAMP3 (0.48)	RAMP3CALCREPHA2KEAP1

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
US-5859187-A	Antiviral peptides	E. R. SQUIBB & SONS, INC. (US)	1999-01-12	—	—	US	disclosed