SCHEMBL30504141

SCHEMBL30504141

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

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NTSR1 P30989 7/20 0.57
▸ NTSR2 O95665 6/20 0.57
▸ SLC6A2 P23975 1/20 0.57
▸ SORT1 Q99523 4/20 0.56
▸ AGTR2 P50052 4/20 0.55
▸ AGTR1 P30556 3/20 0.55
▸ OPRD1 P41143 2/20 0.55
▸ ANPEP P15144 1/20 0.54
▸ LNPEP Q9UIQ6 1/20 0.54

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
SCHEMBL30504145 0.89 F2 (0.67) NTSR1NTSR2SLC6A2OPRD1
SCHEMBL30504147 0.89 F2 (0.67) NTSR1NTSR2SLC6A2OPRD1
SCHEMBL30504153 0.89 F2 (0.67) NTSR1NTSR2SLC6A2OPRD1
SCHEMBL29510563 0.88 NTSR2 (0.58) NTSR1NTSR2SLC6A2SORT1AGTR2
SCHEMBL29860120 0.87 F2 (0.64) NTSR1NTSR2SORT1AGTR2AGTR1
SCHEMBL30727456 0.86 SLC6A2 (0.60) NTSR1NTSR2SLC6A2SORT1AGTR2
SCHEMBL29467322 0.85 OPRD1 (0.56) NTSR1NTSR2SORT1OPRD1
SCHEMBL15094382 0.85 OPRM1 (0.60) SLC6A2OPRD1
SCHEMBL15094385 0.85 OPRM1 (0.60) SLC6A2OPRD1
SCHEMBL30504143 0.84 F2 (0.69) NTSR1NTSR2ANPEPLNPEP

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-109689678-B Agonist peptides for adiponectin receptors B·B·金 2024-04-09 — — CN disclosed
CN-116535469-A Peptides having adiponectin receptor agonist function and agonists of adiponectin receptor B·B·金 2023-08-04 — — CN disclosed
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