Magnesium

Magnesium

SCHEMBL914486

CCC(c1cccc2ccccc12)P(=O)(O)O.CCC(c1cccc2ccccc12)P(=O)(O)O.[Mg]

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 7/20 0.66
CMA1 P23946 3/20 0.47
CTSG P08311 2/20 0.47
CA12 O43570 1/20 0.44
CA2 P00918 1/20 0.44
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP8 P22894 1/20 0.44
MMP14 P50281 1/20 0.44
CA14 Q9ULX7 1/20 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
SCHEMBL915642 0.98 ACP3 (0.68) ACP3CMA1CTSGCA12CA2
SCHEMBL31688360 0.81 ACP3 (0.50) ACP3
SCHEMBL31688369 0.81 ACP3 (0.50) ACP3
SCHEMBL914484 0.81 ACP3 (0.50) ACP3
Lithium Ion SCHEMBL914565 0.81 ACP3 (0.50) ACP3
Lithium Ion SCHEMBL31688364 0.81 ACP3 (0.50) ACP3
SCHEMBL915431 0.81 ACP3 (0.50) ACP3
Magnesium SCHEMBL916910 0.77 ACP3 (0.44) ACP3CA12CA2MMP2MMP9
SCHEMBL28980057 0.76 ACP3 (0.55) ACP3CMA1CTSGCA12CA2
SCHEMBL28980055 0.76 ACP3 (0.55) ACP3CMA1CTSGCA12CA2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7868126-B2 Process for producing polyester, polyester produced using said process, and polyester molded product TOYO BOSEKI KABUSHIKI KAISHA (JP) 2011-01-11 US disclosed
US-20080249280-A1 Process for Producing Polyester, Polyester Produced Using Said Process, and Polyester Molded Product TOYO BOSEKI KABUSHIKI KAISHA (JP) 2008-10-09 US disclosed