SCHEMBL5146835

SCHEMBL5146835

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

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GRIN2D O15399 1/20 0.59
▸ GRIN3B O60391 1/20 0.59
▸ GRIN1 Q05586 1/20 0.59
▸ GRIN2A Q12879 1/20 0.59
▸ GRIN2B Q13224 1/20 0.59
▸ GRIN2C Q14957 1/20 0.59
▸ GRIN3A Q8TCU5 1/20 0.59
▸ TASP1 Q9H6P5 1/20 0.54
▸ BACE1 P56817 6/20 0.51
▸ NTSR2 O95665 1/20 0.45
▸ NTSR1 P30989 1/20 0.45
▸ KISS1R Q969F8 2/20 0.44
▸ MDM4 O15151 1/20 0.44
▸ MDM2 Q00987 1/20 0.44
▸ ENPEP Q07075 5/20 0.44

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
SCHEMBL29372015 1.00 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31563685 0.98 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29988328 0.96 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29986050 0.96 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7591172 0.96 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29375791 0.96 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30483533 0.95 GRIN2D (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31285037 0.94 GRIN2D (0.60) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30401619 0.94 GRIN2D (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31287203 0.93 GRIN2D (0.52) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1425036-A4 VIRUS COAT PROTEIN/RECEPTOR CHIMERAS AND METHODS OF USE UNIV MARYLAND BIOTECH INST (US) 2007-01-10 — — EP disclosed
EP-1425036-A2 VIRUS COAT PROTEIN/RECEPTOR CHIMERAS AND METHODS OF USE University of Maryland Biotechnology Institute (US) 2004-06-09 — — EP disclosed
WO-2003016333-A2 VIRUS COAT PROTEIN/RECEPTOR CHIMERAS AND METHODS OF USE UNIVERSITY OF MARYLAND BIOTECHNOLOGY INSTITUTE (US) 2003-02-27 — — WO disclosed
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