SCHEMBL29619348

SCHEMBL29619348

CC(C)[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.46
DPP4 P27487 1/20 0.46
DPP8 Q6V1X1 1/20 0.46
DPP9 Q86TI2 1/20 0.46
BACE1 P56817 4/20 0.46
CTSD P07339 3/20 0.46
CPB2 Q96IY4 4/20 0.43
NOD1 Q9Y239 1/20 0.43
FURIN P09958 2/20 0.41
PCSK6 P29122 1/20 0.41
SLC6A5 Q9Y345 1/20 0.40
CTSL P07711 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL31441458 0.92 FOLH1 (0.45) FOLH1DPP4DPP8DPP9BACE1
SCHEMBL31170966 0.91 FOLH1 (0.57) FOLH1DPP4DPP8DPP9BACE1
SCHEMBL11087900 0.91 FOLH1 (0.52) FOLH1BACE1CTSDNOD1
SCHEMBL4270994 0.91 FOLH1 (0.48) FOLH1DPP8DPP9CPB2NOD1
SCHEMBL4270981 0.91 FOLH1 (0.48) FOLH1DPP8DPP9CPB2NOD1
SCHEMBL30844406 0.91 BACE1 (0.46) FOLH1DPP4DPP8DPP9BACE1
SCHEMBL30844280 0.91 BACE1 (0.46) FOLH1DPP4DPP8DPP9BACE1
SCHEMBL29402018 0.91 BACE1 (0.44) FOLH1DPP4DPP8DPP9BACE1
SCHEMBL30436842 0.90 FOLH1 (0.47) FOLH1DPP8DPP9CPB2NOD1
SCHEMBL30436412 0.90 FOLH1 (0.47) FOLH1DPP4DPP8DPP9CPB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114835773-A ACE inhibitory peptide and application thereof 浙江海洋大学 2022-08-02 CN disclosed
CN-114835773-A ACE inhibitory peptide and application thereof 浙江海洋大学 2022-08-02 CN disclosed
CN-112521446-B ACE inhibitory peptide and application thereof 浙江海洋大学 2022-06-21 CN disclosed
CN-112521446-B ACE inhibitory peptide and application thereof 浙江海洋大学 2022-06-21 CN disclosed