SCHEMBL30438147

SCHEMBL30438147

N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.57
GSTK1 Q9Y2Q3 1/20 0.57
GLO1 Q04760 1/20 0.47
ENPEP Q07075 6/20 0.46
ANPEP P15144 3/20 0.46
BMP1 P13497 1/20 0.46
FOLH1 Q04609 2/20 0.43
EGFR P00533 1/20 0.42
DPP4 P27487 1/20 0.40
DPP8 Q6V1X1 1/20 0.40
DPP9 Q86TI2 1/20 0.40
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
PTGS2 P35354 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
PGGT1B P53609 1/20 0.38
RIMKLA Q8IXN7 1/20 0.38

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
SCHEMBL30438215 1.00 PTGS1 (0.57) PTGS1GSTK1GLO1ENPEPANPEP
SCHEMBL29892438 0.98 PTGS1 (0.58) PTGS1GSTK1GLO1ENPEPANPEP
SCHEMBL31067315 0.90 PTGS1 (0.56) PTGS1GSTK1GLO1ENPEPANPEP
SCHEMBL30895196 0.90 PTGS1 (0.63) PTGS1GSTK1GLO1ENPEPANPEP
SCHEMBL32670710 0.89 PTGS1 (0.54) PTGS1GSTK1GLO1ENPEPANPEP
SCHEMBL31571920 0.89 PTGS1 (0.59) PTGS1GSTK1GLO1ENPEPANPEP
SCHEMBL29384215 0.88 PTGS1 (0.55) PTGS1GSTK1GLO1ENPEPANPEP
SCHEMBL173099 0.88 PTGS1 (0.55) PTGS1GSTK1GLO1ENPEPANPEP
SCHEMBL209654 0.87 PTGS1 (0.70) PTGS1GSTK1GLO1ENPEPANPEP
SCHEMBL931787 0.87 PTGS1 (0.70) PTGS1GSTK1GLO1ENPEPANPEP

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-113512089-B Polypeptide stabilizer of water-soluble quantum dot and application thereof 兰州大学 2023-06-13 CN disclosed