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SMILES: [H][C@@](C)(CCC(O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])CCC4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)CCNC(=O)CCCCC1SCC2NC(=O)NC12

InChI Key: InChIKey=VLCDTUQNYBBMQZ-UZZKUTSWSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50109031   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
DNA polymerase beta


(Rattus norvegicus)		BDBM50109031
PNG
(4-(10,13-Dimethyl-3-{3-[5-(2-oxo-hexahydro-thieno[...)
Show SMILES [H][C@@](C)(CCC(O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])CCC4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)CCNC(=O)CCCCC1SCC2NC(=O)NC12
Show InChI InChI=1S/C37H59N3O6S/c1-22(8-13-32(42)43)26-11-12-27-25-10-9-23-20-24(14-17-36(23,2)28(25)15-18-37(26,27)3)46-33(44)16-19-38-31(41)7-5-4-6-30-34-29(21-47-30)39-35(45)40-34/h22-30,34H,4-21H2,1-3H3,(H,38,41)(H,42,43)(H2,39,40,45)/t22-,23?,24+,25+,26-,27+,28+,29?,30?,34?,36+,37-/m1/s1
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PubMed
n/an/a 3.10E+4n/an/an/an/an/an/a



Tokyo University of Science

Curated by ChEMBL


Assay Description
Inhibitory effect of the compound on the activity of rat DNA polymerase beta was determined by inhibitory dose curves

Bioorg Med Chem Lett 12: 287-90 (2002)


BindingDB Entry DOI: 10.7270/Q2K936TC
More data for this
Ligand-Target Pair