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BDBM50368502 CHEMBL1788183

SMILES: [O-]S(=O)(=O)c1cc(c2cc(NS(=O)(=O)c3ccc(cc3)-c3ccc(cc3)S(=O)(=O)Nc3ccc4cc(cc(c4c3)S([O-])(=O)=O)S([O-])(=O)=O)ccc2c1)S([O-])(=O)=O

InChI Key: InChIKey=ATGSWBBJPPRPGH-UHFFFAOYSA-J

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50368502   
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
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM50368502
PNG
(CHEMBL1788183)
Show SMILES [O-]S(=O)(=O)c1cc(c2cc(NS(=O)(=O)c3ccc(cc3)-c3ccc(cc3)S(=O)(=O)Nc3ccc4cc(cc(c4c3)S([O-])(=O)=O)S([O-])(=O)=O)ccc2c1)S([O-])(=O)=O
Show InChI InChI=1S/C32H24N2O16S6/c35-51(36,33-23-7-1-21-13-27(53(39,40)41)17-31(29(21)15-23)55(45,46)47)25-9-3-19(4-10-25)20-5-11-26(12-6-20)52(37,38)34-24-8-2-22-14-28(54(42,43)44)18-32(30(22)16-24)56(48,49)50/h1-18,33-34H,(H,39,40,41)(H,42,43,44)(H,45,46,47)(H,48,49,50)/p-4
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

PubMed
n/an/a 1.25E+5n/an/an/an/an/an/a



Universityof Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of purified HIV-2 reverse transcriptase


J Med Chem 35: 4846-53 (1992)


BindingDB Entry DOI: 10.7270/Q2M0461N
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM50368502
PNG
(CHEMBL1788183)
Show SMILES [O-]S(=O)(=O)c1cc(c2cc(NS(=O)(=O)c3ccc(cc3)-c3ccc(cc3)S(=O)(=O)Nc3ccc4cc(cc(c4c3)S([O-])(=O)=O)S([O-])(=O)=O)ccc2c1)S([O-])(=O)=O
Show InChI InChI=1S/C32H24N2O16S6/c35-51(36,33-23-7-1-21-13-27(53(39,40)41)17-31(29(21)15-23)55(45,46)47)25-9-3-19(4-10-25)20-5-11-26(12-6-20)52(37,38)34-24-8-2-22-14-28(54(42,43)44)18-32(30(22)16-24)56(48,49)50/h1-18,33-34H,(H,39,40,41)(H,42,43,44)(H,45,46,47)(H,48,49,50)/p-4
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

PubMed
n/an/a 3.74E+5n/an/an/an/an/an/a



Universityof Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of purified HIV-1 reverse transcriptase


J Med Chem 35: 4846-53 (1992)


BindingDB Entry DOI: 10.7270/Q2M0461N
More data for this
Ligand-Target Pair