SCHEMBL30974368

SCHEMBL30974368

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPEP Q07075 5/20 0.48
▸ GRIN2D O15399 1/20 0.46
▸ GRIN3B O60391 1/20 0.46
▸ GRIN1 Q05586 1/20 0.46
▸ GRIN2A Q12879 1/20 0.46
▸ GRIN2B Q13224 1/20 0.46
▸ GRIN2C Q14957 1/20 0.46
▸ GRIN3A Q8TCU5 1/20 0.46
▸ TASP1 Q9H6P5 1/20 0.45
▸ KISS1R Q969F8 2/20 0.44
▸ NPY4R P50391 3/20 0.44
▸ BACE1 P56817 2/20 0.44
▸ VIPR2 P41587 3/20 0.43
▸ VIPR1 P32241 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ MAPK8 P45983 1/20 0.43
▸ MAPK9 P45984 1/20 0.43
▸ MAPK10 P53779 1/20 0.43
▸ MDM4 O15151 1/20 0.43
▸ MDM2 Q00987 1/20 0.43

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
SCHEMBL4515920 0.92 ENPEP (0.48) ENPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4515922 0.92 ENPEP (0.48) ENPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL31031518 0.91 KISS1R (0.44) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31168167 0.90 ENPEP (0.48) ENPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL31578281 0.90 GRIN2D (0.57) ENPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL29677485 0.90 RXFP1 (0.53) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30863950 0.90 TASP1 (0.49) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29601022 0.89 RXFP1 (0.50) ENPEPRXFP1
SCHEMBL29601319 0.89 RXFP1 (0.50) ENPEPRXFP1
SCHEMBL31031624 0.88 NPY4R (0.48) KISS1RNPY4RNPY1RNPY2RNPY5R

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-2024132726-A1 SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF ACUTE ISCHEMIC STROKE IN HUMANS AND DIFFERENTIAL DIAGNOSIS OF ACUTE ISCHEMIC STROKE FROM INTRACRANIAL HEMORRHAGIC STROKE UNIWERSYTET GDANSKI (PL) 2024-06-27 — — WO disclosed
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