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. Author manuscript; available in PMC: 2013 Oct 1.
Published in final edited form as: Chem Biol Drug Des. 2012 Jul 23;80(4):631–637. doi: 10.1111/j.1747-0285.2012.01428.x

Table 2.

Structure analysis of computationally docked nutlin-like inhibitors

Record number Drug Name Number of drug atoms involved in MDM2 contacts Number of hydrogen bond contacts to MDM2 Number of MDM2 amino acids bound to drug Percentage of nutlin 3a-CM binding amino acids
nutlin 3a-CM 15 0 9 100
ZINC03830283 S-bepridil/Vascor 14 0 10 67
ZINC03831395 Protirelin/Thyrel TRH 9 2 7 55
ZINC11677473 Azaribine/Triazure 10 1 8 44
ZINC01847743 caramiphen, Ordrine AT 13 0 9 67
ZINC03812918 R-bepridil/Vascor 16 0 10 78
ZINC00001446 Prenazone, Feprazone 10 0 9 67
ZINC00537935 Lorcainide hydrochloride 12 0 7 67
ZINC00607836 Doxapramhydrochloride/Dopram 14 0 8 55
ZINC01530778 Phenylbutazone 11 0 9 55
ZINC03831172 Nafronyl-d4 17 1 7 55
ZINC04026871 nandrolone phenylpropionate 15 0 8 55
ZINC00601229 Azelastine 13 0 7 44
ZINC00000452 Mephenoxalone 8 0 5 44
ZINC04534031 Azlocillin 12 0 7 44
ZINC00001732 Midazolam hydrochloride 10 0 7 55