SCHEMBL29558594

SCHEMBL29558594

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 2/20 0.56
▸ IL1RN P18510 1/20 0.53
▸ ERAP2 Q6P179 1/20 0.53
▸ REN P00797 1/20 0.52
▸ EDNRA P25101 1/20 0.51

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
SCHEMBL31442161 0.95 EDNRA (0.51) GHSRIL1RNERAP2RENEDNRA
SCHEMBL31442124 0.92 GHSR (0.52) GHSRIL1RNERAP2RENEDNRA
SCHEMBL31391117 0.91 GHSR (0.59) GHSRIL1RNERAP2
SCHEMBL30051497 0.89 GHSR (0.62) GHSREDNRA
SCHEMBL31442130 0.89 GHSR (0.55) GHSRRENEDNRA
SCHEMBL29357733 0.88 REN (0.57) REN
SCHEMBL31606515 0.87 GHSR (0.66) GHSREDNRA
SCHEMBL31442242 0.87 GHSR (0.53) GHSRIL1RNERAP2
SCHEMBL31657628 0.86 GHSR (0.58) GHSR
SCHEMBL29551519 0.86 GHSR (0.58) GHSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113336825-B Hexapeptide with alpha-glucosidase and alpha-amylase inhibitory activity and application thereof 浙江农林大学 2022-04-05 — — CN claimed
CN-113336825-B Hexapeptide with alpha-glucosidase and alpha-amylase inhibitory activity and application thereof 浙江农林大学 2022-04-05 — — CN disclosed
CN-113336825-B Hexapeptide with alpha-glucosidase and alpha-amylase inhibitory activity and application thereof 浙江农林大学 2022-04-05 — — CN disclosed
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