Reaction Details
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DNA dC->dU-editing enzyme APOBEC-3G
Ligand
BDBM87072
Substrate
n/a
Meas. Tech.
SAR analysis of small molecule inhibitors of APOBEC3G DNA Deaminase via a fluorescence-based single-stranded DNA deaminase assay
Temperature
298.15±n/a K
IC50
>99000±n/a nM
Comments
extracted
Citation
PubChem, PC SAR analysis of small molecule inhibitors of APOBEC3G DNA Deaminase via a fluorescence-based single-stranded DNA deaminase assay PubChem Bioassay (2011)[AID] More Info.:
Target
Name:
DNA dC->dU-editing enzyme APOBEC-3G
Synonyms:
ABC3G_HUMAN | APOBEC3G
Type:
Enzyme Catalytic Domain
Mol. Mass.:
46419.54
Organism:
Homo sapiens (Human)
Description:
gi_13399304
Residue:
384
Sequence:
MKPHFRNTVERMYRDTFSYNFYNRPILSRRNTVWLCYEVKTKGPSRPPLDAKIFRGQVYSELKYHPEMRFFHWFSKWRKLHRDQEYEVTWYISWSPCTKCTRDMATFLAEDPKVTLTIFVARLYYFWDPDYQEALRSLCQKRDGPRATMKIMNYDEFQHCWSKFVYSQRELFEPWNNLPKYYILLHIMLGEILRHSMDPPTFTFNFNNEPWVRGRHETYLCYEVERMHNDTWVLLNQRRGFLCNQAPHKHGFLEGRHAELCFLDVIPFWKLDLDQDYRVTCFTSWSPCFSCAQEMAKFISKNKHVSLCIFTARIYDDQGRCQEGLRTLAEAGAKISIMTYSEFKHCWDTFVDHQGCPFQPWDGLDEHSQDLSGRLRAILQNQEN
Inhibitor
Name:
BDBM87072
Synonyms:
1-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)-2-[[5-[(2-methylthiazol-4-yl)methyl]-1,3,4-oxadiazol-2-yl]thio]ethanone | 1-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-[[5-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone | 1-[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]-2-[[5-[(2-methyl-4-thiazolyl)methyl]-1,3,4-oxadiazol-2-yl]thio]ethanone | 1-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]-2-[[5-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone | MLS-0463504.0001 | cid_16255675
Type:
Small organic molecule
Emp. Form.:
C22H22N4O2S2
Mol. Mass.:
438.566
SMILES:
Cc1nc(Cc2nnc(SCC(=O)c3cc(C)n(Cc4ccccc4)c3C)o2)cs1
Structure:
