Calcium Chloride

Calcium Chloride

SCHEMBL27645563

CCCCCCCCCCCC(=O)OC(=O)[C@@H](N)CCC(=O)OCC(O)CO.Cl[Ca]Cl.[NaH]

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.64
▸ DUSP3 P51452 1/20 0.64
▸ MEN1 O00255 1/20 0.64
▸ KMT2A Q03164 1/20 0.64
▸ LMNA P02545 1/20 0.64
▸ DGKA P23743 1/20 0.56
▸ FAAH O00519 2/20 0.48
▸ P2RY10 O00398 3/20 0.47
▸ GPR174 Q9BXC1 3/20 0.47
▸ GPR34 Q9UPC5 2/20 0.47
▸ CNR2 P34972 3/20 0.46
▸ MAPT P10636 1/20 0.46
▸ ENPP2 Q13822 4/20 0.46
▸ TRPV1 Q8NER1 1/20 0.46
▸ LPAR6 P43657 1/20 0.45
▸ LPAR1 Q92633 1/20 0.45
▸ LPAR4 Q99677 1/20 0.45
▸ LPAR5 Q9H1C0 1/20 0.45
▸ LPAR2 Q9HBW0 1/20 0.45
▸ LPAR3 Q9UBY5 1/20 0.45

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
SCHEMBL27645546 0.95 KDM4E (0.70) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL3397922 0.87 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL28996063 0.87 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
Glyceryl Monostearate SCHEMBL28265889 0.85 LMNA (0.88) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL28016229 0.84 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL16612569 0.81 DGKA (0.49) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL15809550 0.81 DGKA (0.49) KDM4EDUSP3MEN1KMT2ALMNA
Glyceryl Monostearate SCHEMBL11581792 0.81 LMNA (0.90) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL16612566 0.81 DGKA (0.49) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL3024584 0.81 LMNA (0.90) KDM4EDUSP3MEN1KMT2ALMNA

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-1918258-A Thickening composition AJINOMOTO KK (JP) 2007-02-21 — — CN disclosed
Send feedback