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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 2027   
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
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2027
PNG
(2,8-disubstituted dipyridodiazepinone 7 | 2-Chloro...)
Show SMILES CCN1c2nc(Cl)ccc2N(C)C(=O)c2cc(CN(C)c3ccccc3)cnc12
Show InChI InChI=1S/C22H22ClN5O/c1-4-28-20-17(22(29)27(3)18-10-11-19(23)25-21(18)28)12-15(13-24-20)14-26(2)16-8-6-5-7-9-16/h5-13H,4,14H2,1-3H3
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 590n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.



Assay Description
Inhibitory activity against HIV-1 wild-type reverse transcriptase.


J Med Chem 41: 2972-84 (1998)


Article DOI: 10.1021/jm9707030
BindingDB Entry DOI: 10.7270/Q2J964K7
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1027,R876K]/[600-1155]


(Human immunodeficiency virus type 1)
BDBM2027
PNG
(2,8-disubstituted dipyridodiazepinone 7 | 2-Chloro...)
Show SMILES CCN1c2nc(Cl)ccc2N(C)C(=O)c2cc(CN(C)c3ccccc3)cnc12
Show InChI InChI=1S/C22H22ClN5O/c1-4-28-20-17(22(29)27(3)18-10-11-19(23)25-21(18)28)12-15(13-24-20)14-26(2)16-8-6-5-7-9-16/h5-13H,4,14H2,1-3H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 590n/an/an/an/a7.822



Boehringer Ingelheim Pharmaceuticals Inc.



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 41: 2972-84 (1998)


Article DOI: 10.1021/jm9707030
BindingDB Entry DOI: 10.7270/Q2J964K7
More data for this
Ligand-Target Pair