SCHEMBL29657709

SCHEMBL29657709

N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP3 Q9NY33 5/20 0.54
NTSR2 O95665 1/20 0.51
NTSR1 P30989 1/20 0.51
SORT1 Q99523 1/20 0.51
CTSL P07711 3/20 0.50
CTSS P25774 3/20 0.50
CTSK P43235 3/20 0.50
CTSH P09668 1/20 0.50
DPP4 P27487 1/20 0.49
C5AR1 P21730 1/20 0.47
CXCR4 P61073 1/20 0.47
OPRM1 P35372 1/20 0.47

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
SCHEMBL30518114 0.94 DPP3 (0.55) DPP3C5AR1OPRM1
SCHEMBL29649745 0.92 DPP3 (0.58) DPP3NTSR2NTSR1SORT1CTSL
SCHEMBL31674416 0.92 DPP3 (0.59) DPP3C5AR1OPRM1
SCHEMBL31674417 0.92 DPP3 (0.59) DPP3C5AR1OPRM1
SCHEMBL29963309 0.89 DPP3 (0.64) DPP3NTSR2NTSR1SORT1DPP4
SCHEMBL30254337 0.89 DPP3 (0.55) DPP3NTSR2NTSR1SORT1CTSL
SCHEMBL31040595 0.88 DPP3 (0.56) DPP3CTSLCTSSCTSKCTSH
SCHEMBL31474499 0.87 DPP4 (0.61) DPP3NTSR2NTSR1SORT1DPP4
SCHEMBL32691832 0.87 DPP3 (0.62) DPP3C5AR1OPRM1
SCHEMBL30618378 0.87 DPP3 (0.60) DPP3CTSLCTSSCTSKCTSH

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-112048534-B Spanish mackerel protein hydrolysate with resveratrol efficacy improving activity and preparation method thereof 华南理工大学 2022-05-24 CN disclosed