SCHEMBL30819476

SCHEMBL30819476

CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC)C(C)C

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP3 Q9NY33 5/20 0.65
▸ LNPEP Q9UIQ6 3/20 0.54
▸ ANPEP P15144 1/20 0.54
▸ CAPN1 P07384 2/20 0.53
▸ CTSB P07858 2/20 0.53
▸ F13A1 P00488 2/20 0.52
▸ TGM2 P21980 2/20 0.52
▸ AGTR1 P30556 2/20 0.48
▸ AGTR2 P50052 2/20 0.48
▸ NTSR2 O95665 1/20 0.47
▸ NTSR1 P30989 1/20 0.47
▸ SORT1 Q99523 1/20 0.47
▸ ITGB2 P05107 1/20 0.46
▸ ICAM1 P05362 1/20 0.46
▸ ITGAL P20701 1/20 0.46
▸ REN P00797 1/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ TACR2 P21452 1/20 0.46

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
SCHEMBL30050921 0.87 DPP3 (0.67) DPP3CAPN1CTSBF13A1TGM2
SCHEMBL30987851 0.84 DPP3 (0.57) DPP3LNPEPANPEPCAPN1CTSB
SCHEMBL29993422 0.83 DPP3 (0.74) DPP3CAPN1CTSBNTSR2NTSR1
SCHEMBL30093405 0.83 F13A1 (0.58) DPP3CAPN1CTSBF13A1TGM2
SCHEMBL29649746 0.83 DPP3 (0.62) DPP3LNPEPANPEPCAPN1CTSB
SCHEMBL31071616 0.83 DPP3 (0.73) DPP3LNPEPANPEPREN
SCHEMBL29804127 0.83 DPP3 (0.73) DPP3LNPEPANPEPREN
SCHEMBL29993706 0.82 DPP3 (0.68) DPP3REN
SCHEMBL29572021 0.82 DPP3 (0.71) DPP3NTSR2NTSR1SORT1ITGB2
SCHEMBL30052964 0.82 DPP3 (0.69) DPP3CAPN1CTSBNTSR2NTSR1

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-117820431-A Highland barley distillers' grain peptide with uric acid reducing effect, and preparation method and application thereof 中国农业大学 2024-04-05 — — CN disclosed
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