SCHEMBL30727456

SCHEMBL30727456

CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CCC(N)=O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.60
▸ OPRD1 P41143 5/20 0.56
▸ OPRM1 P35372 4/20 0.56
▸ REN P00797 2/20 0.56
▸ NTSR1 P30989 6/20 0.54
▸ NTSR2 O95665 5/20 0.54
▸ SORT1 Q99523 4/20 0.54
▸ AGTR1 P30556 2/20 0.53
▸ AGTR2 P50052 2/20 0.53
▸ NMUR2 Q9GZQ4 2/20 0.52
▸ NMUR1 Q9HB89 2/20 0.52

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
SCHEMBL30383056 0.88 F2 (0.53) SLC6A2OPRD1OPRM1RENNTSR1
SCHEMBL30504141 0.86 NTSR1 (0.57) SLC6A2OPRD1NTSR1NTSR2SORT1
SCHEMBL30382780 0.85 F2 (0.57) SLC6A2OPRD1OPRM1RENAGTR1
SCHEMBL31491082 0.85 NMUR2 (0.54) OPRD1OPRM1NMUR2NMUR1
SCHEMBL6519107 0.84 OPRD1 (0.57) SLC6A2OPRD1OPRM1NMUR2
SCHEMBL29856042 0.83 RAMP3 (0.56) SLC6A2OPRD1OPRM1NTSR1NMUR2
SCHEMBL29445676 0.83 SLC6A2 (0.64) SLC6A2OPRD1OPRM1RENNMUR2
SCHEMBL11443809 0.83 SLC6A2 (0.67) SLC6A2OPRD1OPRM1RENNTSR1
SCHEMBL2039247 0.82 NTSR1 (0.69) NTSR1NTSR2SORT1
SCHEMBL30475368 0.82 OPRD1 (0.55) OPRD1OPRM1RENNMUR2NMUR1

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-117466991-A Fish scale collagen immunostimulatory peptide, preparation method and application 福建省水产研究所(福建水产病害防治中心) 2024-01-30 — — CN disclosed
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