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Sugi Predict / Compounds / SCHEMBL29637829

SCHEMBL29637829

SCHEMBL29637829

CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 2/20 0.68
▸ GLP1R P43220 10/20 0.64
▸ NPY1R P25929 1/20 0.63
▸ NPY2R P49146 1/20 0.63
▸ NPY4R P50391 1/20 0.63
▸ NPY5R Q15761 1/20 0.63
▸ GCGR P47871 4/20 0.62
▸ CCKBR P32239 2/20 0.61
▸ KISS1R Q969F8 1/20 0.60
▸ GIPR P48546 1/20 0.59
▸ CXCR4 P61073 4/20 0.59
▸ F2 P00734 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
SCHEMBL30903283 0.95 C5AR1 (0.68) C5AR1GLP1RNPY1RNPY2RNPY4R
SCHEMBL30495687 0.94 NPY1R (0.68) C5AR1GLP1RNPY1RNPY2RNPY4R
SCHEMBL31182590 0.92 GLP1R (0.68) C5AR1GLP1RNPY1RNPY2RNPY4R
SCHEMBL29965312 0.92 NPY1R (0.68) C5AR1GLP1RNPY1RNPY2RNPY4R
SCHEMBL29429574 0.92 GLP1R (0.69) C5AR1GLP1RNPY1RNPY2RNPY4R
SCHEMBL31182592 0.91 C5AR1 (0.68) C5AR1GLP1RNPY1RNPY2RNPY4R
SCHEMBL31182539 0.91 NPY1R (0.68) C5AR1GLP1RNPY1RNPY2RNPY4R
SCHEMBL31182586 0.91 GLP1R (0.70) C5AR1GLP1RNPY1RNPY2RNPY4R
SCHEMBL30607279 0.90 NPY1R (0.68) C5AR1GLP1RNPY1RNPY2RNPY4R
SCHEMBL31182679 0.90 GLP1R (0.72) GLP1RNPY1RNPY2RNPY4RNPY5R

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-114478783-B ENO2 monoclonal antibody, and preparation method and application thereof 陕西脉元生物科技有限公司 2022-11-29 — — CN disclosed
CN-114478783-A ENO2 monoclonal antibody, 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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