Exenatide

Exenatide

SCHEMBL28323280

CCC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H](N)Cc1c[nH]cn1)C(C)O)C(C)O)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(N)=O.[OH]

nearest known ligand 0.82

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GLP1R

The experimentally established mechanism targets of Exenatide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GLP1R known ✓ P43220 18/20 0.81
GCGR P47871 9/20 0.81
GIPR P48546 6/20 0.80
CCKBR P32239 4/20 0.70
KEAP1 Q14145 1/20 0.69

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
SCHEMBL29429437 1.00 GLP1R (0.81) GLP1RGCGRGIPRCCKBRKEAP1
Exenatide SCHEMBL14634818 1.00 GLP1R (0.81) GLP1RGCGRGIPRCCKBRKEAP1
Exenatide SCHEMBL20509814 1.00 GLP1R (0.81) GLP1RGCGRGIPRCCKBRKEAP1
SCHEMBL31072728 1.00 GLP1R (0.81) GLP1RGCGRGIPRCCKBRKEAP1
Exenatide SCHEMBL29827241 1.00 GLP1R (0.81) GLP1RGCGRGIPRCCKBRKEAP1
Exenatide SCHEMBL29710890 1.00 GLP1R (0.81) GLP1RGCGRGIPRCCKBRKEAP1
Exenatide SCHEMBL28285812 0.99 GLP1R (0.82) GLP1RGCGRGIPRCCKBRKEAP1
Exenatide SCHEMBL29503493 0.99 GLP1R (0.80) GLP1RGCGRGIPRCCKBRKEAP1
SCHEMBL29429438 0.99 GLP1R (0.81) GLP1RGCGRGIPRCCKBRKEAP1
SCHEMBL29357267 0.99 GLP1R (0.81) GLP1RGCGRGIPRCCKBRKEAP1

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-110312532-A Brain-targeted long-acting protein conjugates 韩美药品株式会社 2019-10-08 CN claimed
CN-110312532-A Brain-targeted long-acting protein conjugates 韩美药品株式会社 2019-10-08 CN disclosed