SCHEMBL30853586

SCHEMBL30853586

C[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.52
▸ REN P00797 3/20 0.49
▸ ANPEP P15144 1/20 0.49
▸ LNPEP Q9UIQ6 1/20 0.49
▸ ACE P12821 1/20 0.47
▸ CALCRL Q16602 1/20 0.47
▸ CMA1 P23946 1/20 0.47
▸ OPRM1 P35372 1/20 0.46
▸ OPRD1 P41143 1/20 0.46
▸ OPRK1 P41145 1/20 0.46
▸ AGTR1 P30556 1/20 0.46
▸ AGTR2 P50052 1/20 0.46
▸ CTSL P07711 1/20 0.46
▸ CTSH P09668 1/20 0.46
▸ CTSS P25774 1/20 0.46
▸ CTSK P43235 1/20 0.46

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
SCHEMBL31108671 0.86 REN (0.55) SLC6A2RENANPEPLNPEPOPRM1
SCHEMBL29531965 0.86 SLC6A2 (0.50) SLC6A2RENOPRM1OPRD1OPRK1
SCHEMBL31195334 0.85 CALCRL (0.53) SLC6A2CALCRLOPRM1OPRD1
SCHEMBL30480492 0.85 OPRM1 (0.55) SLC6A2RENOPRM1OPRD1OPRK1
SCHEMBL30480493 0.85 OPRM1 (0.55) SLC6A2RENOPRM1OPRD1OPRK1
SCHEMBL31505800 0.84 CTSL (0.56) CTSLCTSHCTSSCTSK
SCHEMBL30444185 0.84 CALCRL (0.57) SLC6A2ACECALCRLCMA1OPRM1
SCHEMBL31437675 0.84 REN (0.53) SLC6A2RENCALCRLAGTR1AGTR2
SCHEMBL38652354 0.84 SLC6A2 (0.55) SLC6A2RENOPRM1OPRD1OPRK1
SCHEMBL30785948 0.83 SLC6A2 (0.58) SLC6A2RENANPEPLNPEPOPRM1

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-117551170-B ACE (angiotensin converting enzyme) inhibitory peptide as well as preparation method and application thereof 中国科学院烟台海岸带研究所 2024-04-19 — — CN disclosed
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