SCHEMBL29609329

SCHEMBL29609329

CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 8/20 0.55
▸ NPY4R P50391 8/20 0.55
▸ NPY5R Q15761 8/20 0.55
▸ NPY1R P25929 6/20 0.55
▸ GLP1R P43220 6/20 0.50
▸ GIPR P48546 6/20 0.50
▸ TFPI P10646 2/20 0.50
▸ RAMP3 O60896 3/20 0.50
▸ CALCR P30988 3/20 0.50

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
SCHEMBL29609347 0.98 NPY2R (0.56) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30930139 0.92 CALCR (0.56) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30930165 0.92 NPY2R (0.54) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30997388 0.91 NPY2R (0.54) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30930170 0.91 NPY2R (0.54) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30930186 0.91 RAMP3 (0.55) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30930168 0.90 NPY2R (0.53) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30930146 0.90 RAMP3 (0.55) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30930156 0.88 RAMP3 (0.52) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30930136 0.88 RAMP3 (0.52) NPY2RNPY4RNPY5RNPY1RGLP1R

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-112480231-B Bioactive peptide KQSLPPGLAVKDLK, and preparation method and application thereof 上海交通大学 2022-05-24 — — CN claimed
CN-112480231-B Bioactive peptide KQSLPPGLAVKDLK, and preparation method and application thereof 上海交通大学 2022-05-24 — — CN disclosed
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