SCHEMBL31073596

SCHEMBL31073596

C[C@@H](O)[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.59
▸ ECE1 P42892 11/20 0.56
▸ ERAP2 Q6P179 2/20 0.56
▸ IL1RN P18510 1/20 0.53
▸ ERAP1 Q9NZ08 1/20 0.53

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
SCHEMBL29655540 0.97 ACE (0.55) ACEECE1ERAP2IL1RNERAP1
SCHEMBL30567414 0.96 ACE (0.55) ACEECE1ERAP2IL1RNERAP1
SCHEMBL29750395 0.95 ACE (0.59) ACEECE1ERAP2
SCHEMBL30838788 0.93 ACE (0.61) ACEECE1ERAP2
SCHEMBL30130525 0.91 ACE (0.55) ACEECE1ERAP2
SCHEMBL31259940 0.90 ACE (0.57) ACEECE1
SCHEMBL31259936 0.90 ACE (0.57) ACEECE1
SCHEMBL31259935 0.90 ACE (0.57) ACEECE1
SCHEMBL31259938 0.90 ACE (0.57) ACEECE1
SCHEMBL31259937 0.90 ACE (0.57) ACEECE1

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-118777592-A Colloidal gold test strip for detecting anti-PLA 2R antibody, preparation method thereof, kit and application 江南大学 2024-10-15 — — CN disclosed
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