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BDBM50192292 (S)-2-(2-{3-[(5R,6R,8R,9R)-4-amino-9-(tert-butyl-dimethyl-silanyloxy)-6-(tert-butyl-dimethyl-silanyloxymethyl)-2,2-dioxo-1,7-dioxa-2lambda*6*-thia-spiro[4.4]non-3-en-8-yl]-5-methyl-2,6-dioxo-3,6-dihydro-2H-pyrimidin-1-yl}-acetylamino)-succinic acid::CHEMBL264069

SMILES: Cc1cn([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)c(=O)n(CC(=O)N[C@@H](CC(O)=O)C(O)=O)c1=O

InChI Key: InChIKey=XZHULJGVKUMOSZ-MHOKIMLGSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50192292   
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
Human immunodeficiency virus type 1 reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50192292
PNG
((S)-2-(2-{3-[(5R,6R,8R,9R)-4-amino-9-(tert-butyl-d...)
Show SMILES Cc1cn([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)c(=O)n(CC(=O)N[C@@H](CC(O)=O)C(O)=O)c1=O |c:21|
Show InChI InChI=1S/C30H50N4O13SSi2/c1-17-13-34(27(41)33(24(17)38)14-21(35)32-18(26(39)40)12-22(36)37)25-23(46-50(10,11)29(5,6)7)30(19(31)16-48(42,43)47-30)20(45-25)15-44-49(8,9)28(2,3)4/h13,16,18,20,23,25H,12,14-15,31H2,1-11H3,(H,32,35)(H,36,37)(H,39,40)/t18-,20+,23-,25+,30+/m0/s1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.19E+4n/an/an/an/an/an/a



University of Pittsburgh School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of FLAG-p66/HIS-p51-mediated HIV1 reverse transcriptase dimerization


J Med Chem 49: 4834-41 (2006)


Article DOI: 10.1021/jm0604575
BindingDB Entry DOI: 10.7270/Q2GH9HKC
More data for this
Ligand-Target Pair
Human immunodeficiency virus type 1 reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50192292
PNG
((S)-2-(2-{3-[(5R,6R,8R,9R)-4-amino-9-(tert-butyl-d...)
Show SMILES Cc1cn([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)c(=O)n(CC(=O)N[C@@H](CC(O)=O)C(O)=O)c1=O |c:21|
Show InChI InChI=1S/C30H50N4O13SSi2/c1-17-13-34(27(41)33(24(17)38)14-21(35)32-18(26(39)40)12-22(36)37)25-23(46-50(10,11)29(5,6)7)30(19(31)16-48(42,43)47-30)20(45-25)15-44-49(8,9)28(2,3)4/h13,16,18,20,23,25H,12,14-15,31H2,1-11H3,(H,32,35)(H,36,37)(H,39,40)/t18-,20+,23-,25+,30+/m0/s1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 9.10E+3n/an/an/an/an/an/a



University of Pittsburgh School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase RNA-dependent DNA polymerase activity


J Med Chem 49: 4834-41 (2006)


Article DOI: 10.1021/jm0604575
BindingDB Entry DOI: 10.7270/Q2GH9HKC
More data for this
Ligand-Target Pair