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SCHEMBL29505141

SCHEMBL29505141

C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 3/20 0.65
▸ OPRM1 P35372 2/20 0.65
▸ NPBWR1 P48145 10/20 0.58
▸ CCKBR P32239 7/20 0.56
▸ CCKAR P32238 1/20 0.56
▸ PRMT1 Q99873 1/20 0.53

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
Emideltide SCHEMBL5523007 0.94 NPBWR1 (0.57) OPRD1OPRM1NPBWR1CCKBRCCKAR
Emideltide SCHEMBL5523017 0.94 NPBWR1 (0.57) OPRD1OPRM1NPBWR1CCKBRCCKAR
Emideltide SCHEMBL29533932 0.94 NPBWR1 (0.57) OPRD1OPRM1NPBWR1CCKBRCCKAR
SCHEMBL29505086 0.93 OPRD1 (0.73) OPRD1OPRM1NPBWR1CCKBRCCKAR
SCHEMBL29505125 0.89 CCKBR (0.62) OPRD1NPBWR1CCKBRCCKAR
SCHEMBL31206804 0.87 OPRD1 (0.56) OPRD1OPRM1NPBWR1CCKBRCCKAR
SCHEMBL10749608 0.87 OPRD1 (0.68) OPRD1OPRM1NPBWR1CCKBRCCKAR
SCHEMBL11696760 0.86 NPBWR1 (0.57) OPRD1OPRM1NPBWR1CCKBRCCKAR
SCHEMBL30881945 0.86 CCKBR (0.64) OPRD1OPRM1NPBWR1CCKBRCCKAR
SCHEMBL30881872 0.86 CCKBR (0.67) OPRD1OPRM1NPBWR1CCKBRCCKAR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022184163-A1 MODIFIED NONAPEPTIDE, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 北京北科华夏生物医药科技有限公司 2022-09-09 — — WO claimed
WO-2022184163-A1 MODIFIED NONAPEPTIDE, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 北京北科华夏生物医药科技有限公司 2022-09-09 — — WO disclosed
WO-2022184163-A1 MODIFIED NONAPEPTIDE, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 北京北科华夏生物医药科技有限公司 2022-09-09 — — WO disclosed
CN-113214354-B Modified nonapeptide and preparation method and application thereof 北京北科华夏生物医药科技有限公司 2022-03-25 — — CN disclosed
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