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SCHEMBL13356183

SCHEMBL13356183

CCCCCCCCCCCCCCCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(N)=O)[C@@H](C)N=O)[C@@H](C)O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 15/20 0.48
▸ SCTR P47872 1/20 0.48
▸ GCGR P47871 2/20 0.46
▸ APLNR P35414 1/20 0.45
▸ GIPR P48546 1/20 0.44
▸ RAMP3 O60896 1/20 0.44
▸ CALCR P30988 1/20 0.44
▸ ECE1 P42892 1/20 0.43
▸ MUS81 Q96NY9 1/20 0.43

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
SCHEMBL13356182 0.96 GLP1R (0.49) GLP1RSCTRGCGRAPLNRGIPR
SCHEMBL16508473 0.86 NPY5R (0.45) GLP1RSCTRGCGRAPLNR
SCHEMBL16508489 0.85 NPY4R (0.47) GLP1RSCTRAPLNR
SCHEMBL16508481 0.85 TLR2 (0.52) GLP1RGCGRGIPR
SCHEMBL16507848 0.83 APLNR (0.50) GLP1RSCTRGCGRAPLNRGIPR
SCHEMBL16508496 0.83 NPY4R (0.45) GLP1RSCTRAPLNR
SCHEMBL16508438 0.82 NPY4R (0.54) GLP1RSCTRAPLNR
SCHEMBL16508537 0.82 NPY4R (0.49) APLNR
SCHEMBL13356170 0.82 TLR2 (0.48) GLP1RGCGRGIPR
SCHEMBL16508000 0.81 NPY5R (0.63) GLP1RSCTRGCGRAPLNRGIPR

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
WO-2010053547-A2 CXCR5 RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. (US) 2010-05-14 — — WO disclosed
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