SCHEMBL31039952

SCHEMBL31039952

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

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.64
▸ ECE1 P42892 12/20 0.60
▸ ERAP2 Q6P179 1/20 0.57
▸ ALOX15 P16050 1/20 0.57
▸ MAGI3 Q5TCQ9 1/20 0.56

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL29429568 0.94 ACE (0.67) ACEECE1ERAP2ALOX15
SCHEMBL29384048 0.92 ACE (0.59) ACEECE1ERAP2MAGI3
SCHEMBL5583849 0.91 ACE (0.69) ACEECE1ERAP2ALOX15
SCHEMBL5583846 0.91 ACE (0.69) ACEECE1ERAP2ALOX15
SCHEMBL30452439 0.90 ACE (0.62) ACEECE1ERAP2ALOX15MAGI3
SCHEMBL30724706 0.90 ACE (0.62) ACEECE1ERAP2
SCHEMBL29750422 0.90 ACE (0.67) ACEECE1ERAP2ALOX15
SCHEMBL30121605 0.90 ERAP2 (0.67) ACEECE1ERAP2ALOX15
SCHEMBL29379360 0.88 CTSC (0.64) ACEECE1ERAP2
SCHEMBL31307892 0.87 ERBB2 (0.54) ACEECE1ERAP2MAGI3

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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