SCHEMBL30493544

SCHEMBL30493544

CSCC[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(C)C

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 2/20 0.48
▸ RAMP3 O60896 8/20 0.46
▸ CALCR P30988 8/20 0.46
▸ NMUR2 Q9GZQ4 3/20 0.46
▸ NMUR1 Q9HB89 3/20 0.46
▸ NAA50 Q9GZZ1 1/20 0.46
▸ PLK1 P53350 1/20 0.45
▸ PTH1R Q03431 1/20 0.44

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
SCHEMBL29699848 0.91 RAMP3 (0.46) APLNRRAMP3CALCRPLK1
SCHEMBL30493699 0.88 NMUR2 (0.50) APLNRRAMP3CALCRNMUR2NMUR1
SCHEMBL30262143 0.87 RAMP3 (0.56) RAMP3CALCR
SCHEMBL29616327 0.85 MC4R (0.52) RAMP3CALCR
SCHEMBL31326910 0.85 MC4R (0.52) RAMP3CALCR
SCHEMBL30366654 0.85 NMUR2 (0.45) APLNRRAMP3CALCRNMUR2NMUR1
SCHEMBL31031523 0.84 RAMP3 (0.53) RAMP3CALCRNMUR2NMUR1
SCHEMBL30296665 0.84 NMUR2 (0.51) APLNRRAMP3CALCRNMUR2NMUR1
SCHEMBL30906538 0.84 RAMP3 (0.55) RAMP3CALCR
SCHEMBL30471826 0.84 APLNR (0.45) APLNRRAMP3CALCRNMUR2NMUR1

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-116410262-A Tumor affinity peptide and application thereof 中国药科大学 2023-07-11 — — CN disclosed
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