SCHEMBL30271074

SCHEMBL30271074

CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CS)C(=O)NCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 6/20 0.43
▸ BACE1 P56817 1/20 0.43
▸ GLP1R P43220 3/20 0.42
▸ MDM4 O15151 1/20 0.41
▸ MDM2 Q00987 1/20 0.41
▸ CALCR P30988 2/20 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
SCHEMBL30271070 1.00 F2 (0.43) F2BACE1GLP1RMDM4MDM2
SCHEMBL30445684 0.85 GLP1R (0.44) F2BACE1GLP1RCALCR
SCHEMBL30659883 0.83 OPRD1 (0.47) BACE1
SCHEMBL29836387 0.82 GLP1R (0.54) F2GLP1RCALCR
SCHEMBL31420016 0.81 ENPEP (0.47) BACE1MDM4MDM2
SCHEMBL29609528 0.81 GLP1R (0.47) F2GLP1R
SCHEMBL31228781 0.81 OPRD1 (0.42) —
SCHEMBL30512670 0.80 GLP1R (0.47) F2GLP1RCALCR
SCHEMBL31433248 0.80 CALCR (0.46) F2CALCR
SCHEMBL8978166 0.79 HCRTR1 (0.46) F2GLP1RCALCR

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-108888752-B Application of isochrysis galbana polypeptide IZP-2 in preparation of medicine for preventing alcoholic liver injury 广东海洋大学 2023-02-17 — — CN disclosed
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