SCHEMBL29586707

SCHEMBL29586707

NCCCC[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 2/20 0.47
▸ CD40 P25942 3/20 0.47
▸ OPRM1 P35372 7/20 0.46
▸ OPRD1 P41143 7/20 0.46
▸ F2 P00734 4/20 0.44
▸ MC4R P32245 1/20 0.44
▸ APC P25054 1/20 0.44
▸ GLP1R P43220 2/20 0.43
▸ SCTR P47872 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
SCHEMBL29582481 0.90 NAALAD2 (0.46) OPRM1OPRD1F2APC
SCHEMBL31031530 0.90 OPRD1 (0.48) C5AR1OPRM1OPRD1F2GLP1R
SCHEMBL31694488 0.90 C5AR1 (0.58) C5AR1MC4RGLP1RSCTR
SCHEMBL29536767 0.90 C5AR1 (0.56) C5AR1F2GLP1R
SCHEMBL30536318 0.87 F2 (0.58) F2GLP1R
SCHEMBL6824254 0.86 LNPEP (0.47) C5AR1OPRM1OPRD1
SCHEMBL6824252 0.86 LNPEP (0.47) C5AR1OPRM1OPRD1
SCHEMBL29800072 0.86 F2 (0.46) C5AR1F2GLP1RSCTR
SCHEMBL31419818 0.85 NPY4R (0.46) C5AR1
SCHEMBL30688994 0.84 NAALAD2 (0.52) OPRM1

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-114409730-A Active peptide, active peptide composition and application of active peptide composition in preparation of product with anti-aging effect 深圳科兴药业有限公司 2022-04-29 — — CN disclosed
Send feedback