BindingDB logo
myBDB logout

BDBM50075212 CHEMBL3414862

SMILES: ON1C(=O)Cc2cc(Cc3ccc(cc3)C(F)(F)F)ccc2C1=O

InChI Key: InChIKey=UBHLPWPNFMBLAM-UHFFFAOYSA-N

Data: 7 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 7 hits for monomerid = 50075212   
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


(Human immunodeficiency virus 1)
BDBM50075212
PNG
(CHEMBL3414862)
Show SMILES ON1C(=O)Cc2cc(Cc3ccc(cc3)C(F)(F)F)ccc2C1=O
Show InChI InChI=1S/C17H12F3NO3/c18-17(19,20)13-4-1-10(2-5-13)7-11-3-6-14-12(8-11)9-15(22)21(24)16(14)23/h1-6,8,24H,7,9H2
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.90E+3n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of Moloney murine leukemia virus reverse transcriptase polymerase activity using Td100/Pd18 DNA-DNA substrate incubated for 30 mins by flu...


J Med Chem 58: 651-64 (2015)


Article DOI: 10.1021/jm501132s
BindingDB Entry DOI: 10.7270/Q2W95BWG
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)
BDBM50075212
PNG
(CHEMBL3414862)
Show SMILES ON1C(=O)Cc2cc(Cc3ccc(cc3)C(F)(F)F)ccc2C1=O
Show InChI InChI=1S/C17H12F3NO3/c18-17(19,20)13-4-1-10(2-5-13)7-11-3-6-14-12(8-11)9-15(22)21(24)16(14)23/h1-6,8,24H,7,9H2
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of HIV integrase pre-incubated for 10 mins before DNA substrate addition


J Med Chem 58: 651-64 (2015)


Article DOI: 10.1021/jm501132s
BindingDB Entry DOI: 10.7270/Q2W95BWG
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM50075212
PNG
(CHEMBL3414862)
Show SMILES ON1C(=O)Cc2cc(Cc3ccc(cc3)C(F)(F)F)ccc2C1=O
Show InChI InChI=1S/C17H12F3NO3/c18-17(19,20)13-4-1-10(2-5-13)7-11-3-6-14-12(8-11)9-15(22)21(24)16(14)23/h1-6,8,24H,7,9H2
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of HIV1 recombinant reverse transcriptase associated catalytically active RNase H domain assessed as reduction in DNA 3' end directed clea...


J Med Chem 58: 651-64 (2015)


Article DOI: 10.1021/jm501132s
BindingDB Entry DOI: 10.7270/Q2W95BWG
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50075212
PNG
(CHEMBL3414862)
Show SMILES ON1C(=O)Cc2cc(Cc3ccc(cc3)C(F)(F)F)ccc2C1=O
Show InChI InChI=1S/C17H12F3NO3/c18-17(19,20)13-4-1-10(2-5-13)7-11-3-6-14-12(8-11)9-15(22)21(24)16(14)23/h1-6,8,24H,7,9H2
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.30E+3n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of HIV1 recombinant reverse transcriptase polymerase activity using [3H]TTP and poly(rA)-oligo(dT)16 substrate incubated for 20 mins by li...


J Med Chem 58: 651-64 (2015)


Article DOI: 10.1021/jm501132s
BindingDB Entry DOI: 10.7270/Q2W95BWG
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM50075212
PNG
(CHEMBL3414862)
Show SMILES ON1C(=O)Cc2cc(Cc3ccc(cc3)C(F)(F)F)ccc2C1=O
Show InChI InChI=1S/C17H12F3NO3/c18-17(19,20)13-4-1-10(2-5-13)7-11-3-6-14-12(8-11)9-15(22)21(24)16(14)23/h1-6,8,24H,7,9H2
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of HIV1 recombinant reverse transcriptase associated catalytically active RNase H domain assessed as reduction in RNA 5' end directed clea...


J Med Chem 58: 651-64 (2015)


Article DOI: 10.1021/jm501132s
BindingDB Entry DOI: 10.7270/Q2W95BWG
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM50075212
PNG
(CHEMBL3414862)
Show SMILES ON1C(=O)Cc2cc(Cc3ccc(cc3)C(F)(F)F)ccc2C1=O
Show InChI InChI=1S/C17H12F3NO3/c18-17(19,20)13-4-1-10(2-5-13)7-11-3-6-14-12(8-11)9-15(22)21(24)16(14)23/h1-6,8,24H,7,9H2
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of reconstituted HIV1 RNase H using RNA/DNA duplex substrate by fluorescence assay


J Med Chem 58: 651-64 (2015)


Article DOI: 10.1021/jm501132s
BindingDB Entry DOI: 10.7270/Q2W95BWG
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM50075212
PNG
(CHEMBL3414862)
Show SMILES ON1C(=O)Cc2cc(Cc3ccc(cc3)C(F)(F)F)ccc2C1=O
Show InChI InChI=1S/C17H12F3NO3/c18-17(19,20)13-4-1-10(2-5-13)7-11-3-6-14-12(8-11)9-15(22)21(24)16(14)23/h1-6,8,24H,7,9H2
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of HIV1 recombinant reverse transcriptase associated catalytically active RNase H domain assessed as reduction in internal cleavage using ...


J Med Chem 58: 651-64 (2015)


Article DOI: 10.1021/jm501132s
BindingDB Entry DOI: 10.7270/Q2W95BWG
More data for this
Ligand-Target Pair