Sugi Predict

Sugi Predict / Compounds / SCHEMBL30690152

SCHEMBL30690152

SCHEMBL30690152

C[C@@H](O)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.67
▸ OPRM1 P35372 5/20 0.60
▸ OPRD1 P41143 4/20 0.60
▸ EPHA2 P29317 2/20 0.57

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
SCHEMBL30495883 0.95 SLC6A2 (0.61) SLC6A2OPRM1OPRD1EPHA2
SCHEMBL29457313 0.93 SLC6A2 (0.69) SLC6A2OPRM1OPRD1EPHA2
SCHEMBL29934589 0.90 OPRM1 (0.58) SLC6A2OPRM1OPRD1EPHA2
SCHEMBL30690151 0.89 SLC6A2 (0.55) SLC6A2OPRM1OPRD1EPHA2
SCHEMBL30233902 0.89 OPRM1 (0.62) SLC6A2OPRM1OPRD1EPHA2
SCHEMBL31265321 0.89 SLC6A2 (0.59) SLC6A2OPRM1OPRD1EPHA2
SCHEMBL30906006 0.89 NTSR1 (0.57) SLC6A2
SCHEMBL30943512 0.88 NTSR2 (0.56) SLC6A2OPRM1OPRD1
SCHEMBL31167328 0.88 SLC6A2 (0.65) SLC6A2OPRM1OPRD1
SCHEMBL30953187 0.88 SLC6A2 (0.64) SLC6A2OPRM1OPRD1EPHA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117219168-B Rapid screening method of high-activity alpha-glycosidase inhibitory peptide and application thereof 中国农业科学院蜜蜂研究所 2024-03-08 — — CN disclosed
CN-117219168-A Rapid screening method of high-activity alpha-glycosidase inhibitory peptide and application thereof 中国农业科学院蜜蜂研究所 2023-12-12 — — CN disclosed