SCHEMBL29833349

SCHEMBL29833349

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

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ENPEP Q07075 18/20 0.64
▸ BACE1 P56817 1/20 0.48

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
SCHEMBL29833172 0.92 ENPEP (0.59) ENPEPBACE1
SCHEMBL30876822 0.88 ENPEP (0.70) ENPEPBACE1
SCHEMBL29362273 0.86 ENPEP (0.61) ENPEPBACE1
SCHEMBL29630434 0.86 ENPEP (0.54) ENPEPBACE1
SCHEMBL31029885 0.86 FOLH1 (0.49) ENPEP
SCHEMBL29892622 0.85 ENPEP (0.58) ENPEPBACE1
SCHEMBL29788346 0.85 ENPEP (0.74) ENPEPBACE1
SCHEMBL30975110 0.84 ENPEP (0.54) ENPEPBACE1
SCHEMBL30075908 0.84 ENPEP (0.57) ENPEP
SCHEMBL30414336 0.83 BMP1 (0.52) ENPEP

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-113106147-B Three-dimensional DNA nano machine driven by exonuclease III and application thereof 山东师范大学 2022-08-02 — — CN disclosed
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