SCHEMBL31039961

CC(C)[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O

nearest known ligand 0.58

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	MAGI3	Q5TCQ9	1/20	0.58

▸	ERBB2	P04626	1/20	0.56

▸	ACE	P12821	2/20	0.54

▸	ECE1	P42892	11/20	0.53

▸	ERAP2	Q6P179	1/20	0.51

▸	CASP1	P29466	1/20	0.49

▸	CASP3	P42574	1/20	0.49

▸	CASP7	P55210	1/20	0.49

▸	CTSC	P53634	1/20	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
SCHEMBL30834729	0.93	ACE (0.61)	ACEECE1ERAP2
SCHEMBL30123268	0.90	ACE (0.66)	ACEECE1ERAP2CTSC
SCHEMBL9113857	0.89	ECE1 (0.57)	MAGI3ERBB2ACEECE1ERAP2
SCHEMBL29750422	0.89	ACE (0.67)	ACEECE1ERAP2
SCHEMBL30567428	0.87	ACE (0.61)	MAGI3ACEECE1ERAP2CTSC
SCHEMBL29658139	0.87	ACE (0.58)	MAGI3ERBB2ACEECE1
SCHEMBL29364793	0.87	ACE (0.58)	ERBB2ACEECE1
SCHEMBL29492470	0.86	ACE (0.62)	ACEECE1ERAP2
SCHEMBL7402303	0.86	ACE (0.55)	MAGI3ACEECE1
SCHEMBL7402300	0.86	ACE (0.55)	MAGI3ACEECE1

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-116970080-B	Anti-human MFAP5 monoclonal antibody and preparation method thereof, polynucleotide molecule, expression vector and host cell	优睿赛思(武汉)生物科技有限公司	2024-08-13	—	—	CN	disclosed