BindingDB logo
myBDB logout

null

SMILES: Brc1cc2[nH]cnc2c2ccccc12

InChI Key: InChIKey=NOQABCGGRDYROW-UHFFFAOYSA-N

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 6 hits for monomerid = 54967   
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
Core protein


(Hepatitis C virus)
BDBM54967
PNG
(5-bromanyl-3H-benzo[e]benzimidazole | 5-bromo-1H-n...)
Show SMILES Brc1cc2[nH]cnc2c2ccccc12
Show InChI InChI=1S/C11H7BrN2/c12-9-5-10-11(14-6-13-10)8-4-2-1-3-7(8)9/h1-6H,(H,13,14)
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>4.98E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29Z939R
More data for this
Ligand-Target Pair
Glucose-6-phosphate 1-dehydrogenase


(Homo sapiens (Human))
BDBM54967
PNG
(5-bromanyl-3H-benzo[e]benzimidazole | 5-bromo-1H-n...)
Show SMILES Brc1cc2[nH]cnc2c2ccccc12
Show InChI InChI=1S/C11H7BrN2/c12-9-5-10-11(14-6-13-10)8-4-2-1-3-7(8)9/h1-6H,(H,13,14)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>8.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2V12389
More data for this
Ligand-Target Pair
Major prion protein


(Homo sapiens (Human))
BDBM54967
PNG
(5-bromanyl-3H-benzo[e]benzimidazole | 5-bromo-1H-n...)
Show SMILES Brc1cc2[nH]cnc2c2ccccc12
Show InChI InChI=1S/C11H7BrN2/c12-9-5-10-11(14-6-13-10)8-4-2-1-3-7(8)9/h1-6H,(H,13,14)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 5.96E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2HM573M
More data for this
Ligand-Target Pair
Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase


(Plasmodium falciparum 3D7)
BDBM54967
PNG
(5-bromanyl-3H-benzo[e]benzimidazole | 5-bromo-1H-n...)
Show SMILES Brc1cc2[nH]cnc2c2ccccc12
Show InChI InChI=1S/C11H7BrN2/c12-9-5-10-11(14-6-13-10)8-4-2-1-3-7(8)9/h1-6H,(H,13,14)
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>8.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q27H1H3W
More data for this
Ligand-Target Pair
Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase


(Plasmodium falciparum 3D7)
BDBM54967
PNG
(5-bromanyl-3H-benzo[e]benzimidazole | 5-bromo-1H-n...)
Show SMILES Brc1cc2[nH]cnc2c2ccccc12
Show InChI InChI=1S/C11H7BrN2/c12-9-5-10-11(14-6-13-10)8-4-2-1-3-7(8)9/h1-6H,(H,13,14)
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>8.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q23T9FQ1
More data for this
Ligand-Target Pair
Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase


(Plasmodium falciparum 3D7)
BDBM54967
PNG
(5-bromanyl-3H-benzo[e]benzimidazole | 5-bromo-1H-n...)
Show SMILES Brc1cc2[nH]cnc2c2ccccc12
Show InChI InChI=1S/C11H7BrN2/c12-9-5-10-11(14-6-13-10)8-4-2-1-3-7(8)9/h1-6H,(H,13,14)
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.76E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2ZS2TZG
More data for this
Ligand-Target Pair