SCHEMBL30668166

SCHEMBL30668166

CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)CC

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NPY1R P25929 4/20 0.59
▸ NTSR1 P30989 6/20 0.57
▸ NTSR2 O95665 3/20 0.57
▸ NPY2R P49146 1/20 0.56
▸ NPY4R P50391 1/20 0.56
▸ NPY5R Q15761 1/20 0.56
▸ F2 P00734 4/20 0.54
▸ OPRD1 P41143 3/20 0.53
▸ OPRM1 P35372 2/20 0.53
▸ SORT1 Q99523 2/20 0.52

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
SCHEMBL38660346 0.90 OPRD1 (0.62) NPY1RNTSR1NTSR2NPY2RNPY4R
SCHEMBL31366789 0.87 OPRM1 (0.54) NPY1RNPY2RNPY4RNPY5RF2
SCHEMBL31257916 0.86 NTSR1 (0.52) NPY1RNTSR1NTSR2NPY2RNPY4R
SCHEMBL30432136 0.85 F2 (0.64) NPY1RNPY2RNPY4RNPY5RF2
SCHEMBL31598477 0.84 OPRD1 (0.64) NTSR1NTSR2F2OPRD1SORT1
SCHEMBL18911399 0.84 NTSR1 (0.57) NPY1RNTSR1NTSR2NPY2RNPY4R
SCHEMBL18911398 0.84 NTSR1 (0.57) NPY1RNTSR1NTSR2NPY2RNPY4R
SCHEMBL31598484 0.84 OPRD1 (0.65) NTSR1NTSR2F2OPRD1SORT1
SCHEMBL31606484 0.84 NPY1R (0.56) NPY1RNTSR1NTSR2OPRM1SORT1
SCHEMBL30262084 0.83 F2 (0.60) NPY1RNTSR1NTSR2NPY2RNPY4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117186233-A Mycobacterium tuberculosis c-di-AMP (adenosine triphosphate) catabolic enzyme monoclonal antibody as well as preparation method and application thereof 中国人民解放军空军军医大学 2023-12-08 — — CN disclosed
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