SCHEMBL29848357

SCHEMBL29848357

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

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.51
▸ NMUR2 Q9GZQ4 5/20 0.51
▸ NMUR1 Q9HB89 4/20 0.51
▸ OPRM1 P35372 1/20 0.50
▸ NTSR2 O95665 1/20 0.49
▸ NTSR1 P30989 1/20 0.49
▸ EPHA2 P29317 2/20 0.48
▸ CXCL8 P10145 1/20 0.48
▸ CALCRL Q16602 1/20 0.48

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
SCHEMBL29607994 0.85 SLC6A2 (0.59) SLC6A2OPRM1
SCHEMBL31267154 0.85 NMUR2 (0.61) NMUR2NMUR1NTSR2NTSR1
SCHEMBL30512601 0.82 NTSR1 (0.58) NTSR2NTSR1EPHA2
SCHEMBL31108650 0.82 SLC6A2 (0.59) SLC6A2OPRM1NTSR2NTSR1
SCHEMBL29591081 0.81 NTSR1 (0.53) SLC6A2NMUR2NMUR1OPRM1NTSR2
SCHEMBL29760530 0.81 SLC6A2 (0.60) SLC6A2NMUR2NMUR1NTSR2NTSR1
SCHEMBL30444233 0.81 SLC6A2 (0.57) SLC6A2NMUR2OPRM1NTSR2NTSR1
SCHEMBL13311989 0.81 CALCRL (0.56) SLC6A2OPRM1EPHA2CALCRL
SCHEMBL31239042 0.80 NTSR1 (0.58) SLC6A2NMUR2NMUR1OPRM1NTSR2
SCHEMBL30785408 0.80 ACE (0.59) SLC6A2

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-113151387-B Cod skin collagen peptide with oxidation resistance and immunity enhancement functions and preparation method thereof 安徽国肽生物科技有限公司 2022-08-16 — — CN disclosed
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