BindingDB logo
myBDB logout

PubMed code 15686877

Compile data set for download or QSAR
Found 2 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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)
BDBM50370476
PNG
(Combivir | ZIDOVUDINE TRIPHOSPHATE)
Show SMILES Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](CO[P@@](O)(=O)O[P@@](O)(=O)OP(O)(O)=O)O2)c(=O)[nH]c1=O |r|
Show InChI InChI=1S/C10H16N5O13P3/c1-5-3-15(10(17)12-9(5)16)8-2-6(13-14-11)7(26-8)4-25-30(21,22)28-31(23,24)27-29(18,19)20/h3,6-8H,2,4H2,1H3,(H,21,22)(H,23,24)(H,12,16,17)(H2,18,19,20)/t6-,7+,8+/m0/s1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

KEGG
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/a 2.10E+3n/an/an/an/an/an/a



Universit£t Konstanz

Curated by ChEMBL


Assay Description
Inhibitory concentration against human immunodeficiency virus type 1 reverse transcriptase


Bioorg Med Chem Lett 15: 869-71 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.072
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Human immunodeficiency virus type 1 reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50160555
PNG
([(2R,3S,5R)-2-ethynyl-3-hydroxy-5-(5-methyl-2,4-di...)
Show SMILES Cc1cn([C@H]2C[C@H](O)[C@@](COP([O-])(=O)OP([O-])(=O)OP([O-])([O-])=O)(O2)C#C)c(=O)[nH]c1=O
Show InChI InChI=1S/C12H17N2O14P3/c1-3-12(6-25-30(21,22)28-31(23,24)27-29(18,19)20)8(15)4-9(26-12)14-5-7(2)10(16)13-11(14)17/h1,5,8-9,15H,4,6H2,2H3,(H,21,22)(H,23,24)(H,13,16,17)(H2,18,19,20)/p-4/t8-,9+,12+/m0/s1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.28E+3n/an/an/an/an/an/a



Universit£t Konstanz

Curated by ChEMBL


Assay Description
Inhibitory concentration against human immunodeficiency virus type 1 reverse transcriptase


Bioorg Med Chem Lett 15: 869-71 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.072
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%