SCHEMBL30456526

SCHEMBL30456526

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 2/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.45
▸ PSEN1 P49768 3/20 0.44
▸ PSEN2 P49810 3/20 0.44
▸ APH1B Q8WW43 3/20 0.44
▸ NCSTN Q92542 3/20 0.44
▸ APH1A Q96BI3 3/20 0.44
▸ PSENEN Q9NZ42 3/20 0.44
▸ PRSS1 P07477 1/20 0.44
▸ GRIN2D O15399 1/20 0.43
▸ GRIN3B O60391 1/20 0.43
▸ GRIN1 Q05586 1/20 0.43
▸ GRIN2A Q12879 1/20 0.43
▸ GRIN2B Q13224 1/20 0.43
▸ GRIN2C Q14957 1/20 0.43
▸ GRIN3A Q8TCU5 1/20 0.43
▸ CTSD P07339 2/20 0.42
▸ REN P00797 1/20 0.42
▸ CTSB P07858 1/20 0.41
▸ CTSK P43235 1/20 0.41

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
SCHEMBL30964326 0.88 GRIN2D (0.46) FURINRXFP1PRSS1GRIN2DGRIN3B
SCHEMBL29912721 0.88 FURIN (0.47) FURINRXFP1PSEN1PSEN2APH1B
SCHEMBL28539679 0.87 FURIN (0.41) FURINRXFP1PRSS1CTSDREN
SCHEMBL28539678 0.87 FURIN (0.41) FURINRXFP1PRSS1CTSDREN
SCHEMBL30964328 0.87 GRIN2D (0.43) FURINRXFP1PRSS1GRIN2DGRIN3B
Gigiltvil SCHEMBL30741431 0.86 CTSD (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL30259455 0.86 FURIN (0.46) FURINPSEN1PSEN2APH1BNCSTN
SCHEMBL30518883 0.84 CTSD (0.39) CTSDREN
SCHEMBL30202309 0.84 CTSD (0.43) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30739462 0.84 CTSD (0.44) RXFP1CTSDRENCTSBCTSK

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-116178520-A Cationic peptide and application thereof 浙江大学医学院附属第一医院 2023-05-30 — — CN disclosed
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