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SCHEMBL29418159

SCHEMBL29418159

CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.64
▸ OPRD1 P41143 6/20 0.60
▸ OPRM1 P35372 4/20 0.60
▸ OPRK1 P41145 3/20 0.60
▸ NMUR2 Q9GZQ4 1/20 0.56
▸ NMUR1 Q9HB89 1/20 0.56
▸ NTSR2 O95665 2/20 0.54
▸ NTSR1 P30989 2/20 0.54
▸ SORT1 Q99523 2/20 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
SCHEMBL31369289 0.93 SLC6A2 (0.70) SLC6A2OPRD1OPRM1OPRK1NMUR2
SCHEMBL31369335 0.93 SLC6A2 (0.70) SLC6A2OPRD1OPRM1OPRK1NMUR2
SCHEMBL31369301 0.91 SLC6A2 (0.66) SLC6A2OPRD1OPRM1OPRK1NMUR2
SCHEMBL31369284 0.90 SLC6A2 (0.67) SLC6A2OPRD1OPRM1OPRK1NMUR2
SCHEMBL31307249 0.89 SLC6A2 (0.66) SLC6A2OPRD1OPRM1OPRK1NTSR2
SCHEMBL31415949 0.89 SLC6A2 (0.63) SLC6A2OPRD1OPRM1NTSR2NTSR1
SCHEMBL29536416 0.88 OPRD1 (0.66) OPRD1OPRM1OPRK1
SCHEMBL31005072 0.88 OPRD1 (0.60) OPRD1OPRM1OPRK1NMUR2
SCHEMBL31369283 0.87 SLC6A2 (0.71) SLC6A2OPRD1OPRM1OPRK1NMUR2
SCHEMBL31307281 0.87 SLC6A2 (0.58) SLC6A2OPRM1NTSR2NTSR1SORT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112481246-B Bioactive polypeptide FSPANKKLTPKKY, and preparation method and application thereof 熊猫乳品集团股份有限公司 2022-03-29 — — CN claimed
CN-112481246-B Bioactive polypeptide FSPANKKLTPKKY, and preparation method and application thereof 熊猫乳品集团股份有限公司 2022-03-29 — — CN disclosed
CN-112481246-B Bioactive polypeptide FSPANKKLTPKKY, and preparation method and application thereof 熊猫乳品集团股份有限公司 2022-03-29 — — CN disclosed
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