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Sugi Predict / Compounds / SCHEMBL29530804

SCHEMBL29530804

SCHEMBL29530804

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(C)C)[C@@H](C)O)C(=O)NCC(=O)O

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 9/20 0.65
▸ CCKBR P32239 4/20 0.65
▸ CALCR P30988 4/20 0.63
▸ KEAP1 Q14145 2/20 0.61
▸ NMBR P28336 1/20 0.61
▸ GRPR P30550 1/20 0.61
▸ NPY1R P25929 1/20 0.60
▸ NPY2R P49146 1/20 0.60
▸ NPY4R P50391 1/20 0.60
▸ NPY5R Q15761 1/20 0.60
▸ CRHR1 P34998 1/20 0.59
▸ CRHR2 Q13324 1/20 0.59
▸ GCGR P47871 1/20 0.59
▸ GIPR P48546 1/20 0.59

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
SCHEMBL29811055 0.91 GLP1R (0.68) GLP1RCCKBRCALCRKEAP1NMBR
SCHEMBL30883220 0.90 CXCR4 (0.64) GLP1RCCKBRCALCRNMBRGRPR
SCHEMBL29625335 0.89 NPY1R (0.69) GLP1RCCKBRCALCRKEAP1NPY1R
SCHEMBL30495703 0.89 GLP1R (0.72) GLP1RCCKBRKEAP1NPY1RNPY2R
SCHEMBL30495677 0.89 NPY1R (0.72) GLP1RCCKBRCALCRNPY1RNPY2R
SCHEMBL30658220 0.89 GLP1R (0.72) GLP1RCCKBRCALCRNPY1RNPY2R
SCHEMBL31105353 0.88 GLP1R (0.70) GLP1RCCKBRCALCRNPY1RNPY2R
SCHEMBL31182636 0.88 GLP1R (0.68) GLP1RCCKBRCALCRKEAP1NPY1R
SCHEMBL31182914 0.88 CALCR (0.69) GLP1RCCKBRCALCRNMBRGRPR
SCHEMBL31182843 0.88 F2 (0.62) GLP1RCCKBRCALCRNMBRGRPR

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-114478784-B ENO2 monoclonal antibody 1C5, and preparation method and application thereof 陕西脉元生物科技有限公司 2022-11-25 — — CN disclosed
CN-114478784-A ENO2 monoclonal antibody 1C5, and preparation method and application thereof 陕西脉元生物科技有限公司 2022-05-13 — — CN disclosed
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