SCHEMBL29933967

SCHEMBL29933967

CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)CN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GRIN2D O15399 1/20 0.63
▸ GRIN3B O60391 1/20 0.63
▸ GRIN1 Q05586 1/20 0.63
▸ GRIN2A Q12879 1/20 0.63
▸ GRIN2B Q13224 1/20 0.63
▸ GRIN2C Q14957 1/20 0.63
▸ GRIN3A Q8TCU5 1/20 0.63
▸ TASP1 Q9H6P5 1/20 0.51
▸ BACE1 P56817 1/20 0.47
▸ ENPEP Q07075 5/20 0.47
▸ VIPR2 P41587 3/20 0.43
▸ VIPR1 P32241 1/20 0.43
▸ F2 P00734 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42

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
SCHEMBL9302800 0.94 GRIN2D (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL9302786 0.94 GRIN2D (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31318928 0.91 GRIN2D (0.55) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29919624 0.89 BACE1 (0.54) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29479874 0.88 GRIN2D (0.55) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31738162 0.87 BACE1 (0.62) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30512778 0.87 GRIN2D (0.56) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30578947 0.86 BACE1 (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL10590691 0.86 ENPEP (0.53) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30477366 0.86 BACE1 (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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
WO-2022197266-A1 BETA-LACTOGLOBULIN AND BETA-LACTOGLOBULIN DERIVED PEPTIDE PRODUCTS FROM GOAT MILK MARMARA UNIVERSITESI REKTORLUGU OZEL KALEM BİRİMİ (TR) 2022-09-22 — — WO disclosed
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