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BDBM76022 5-bromanyl-N-[4-(6-methoxypyridazin-3-yl)phenyl]furan-2-carboxamide::5-bromo-N-[4-(6-methoxy-3-pyridazinyl)phenyl]-2-furancarboxamide::5-bromo-N-[4-(6-methoxypyridazin-3-yl)phenyl]-2-furamide::5-bromo-N-[4-(6-methoxypyridazin-3-yl)phenyl]furan-2-carboxamide::MLS001236653::SMR000812782::cid_7593595

SMILES: COc1ccc(nn1)-c1ccc(NC(=O)c2ccc(Br)o2)cc1

InChI Key: InChIKey=MXKYKPVERUGGDH-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 = 76022   
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
nuclear receptor corepressor 2 isoform 2


(Homo sapiens (Human))
BDBM76022
PNG
(5-bromanyl-N-[4-(6-methoxypyridazin-3-yl)phenyl]fu...)
Show SMILES COc1ccc(nn1)-c1ccc(NC(=O)c2ccc(Br)o2)cc1
Show InChI InChI=1S/C16H12BrN3O3/c1-22-15-9-6-12(19-20-15)10-2-4-11(5-3-10)18-16(21)13-7-8-14(17)23-13/h2-9H,1H3,(H,18,21)
PDB
MMDB

B.MOAD
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PC cid
PC sid
UniChem

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PCBioAssay
n/an/a 4.70E+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 Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q26T0K34
More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens (Human))
BDBM76022
PNG
(5-bromanyl-N-[4-(6-methoxypyridazin-3-yl)phenyl]fu...)
Show SMILES COc1ccc(nn1)-c1ccc(NC(=O)c2ccc(Br)o2)cc1
Show InChI InChI=1S/C16H12BrN3O3/c1-22-15-9-6-12(19-20-15)10-2-4-11(5-3-10)18-16(21)13-7-8-14(17)23-13/h2-9H,1H3,(H,18,21)
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n/an/a 3.38E+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 Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2BK19S0
More data for this
Ligand-Target Pair
tyrosine-protein phosphatase non-receptor type 5 isoform a


(Homo sapiens (Human))
BDBM76022
PNG
(5-bromanyl-N-[4-(6-methoxypyridazin-3-yl)phenyl]fu...)
Show SMILES COc1ccc(nn1)-c1ccc(NC(=O)c2ccc(Br)o2)cc1
Show InChI InChI=1S/C16H12BrN3O3/c1-22-15-9-6-12(19-20-15)10-2-4-11(5-3-10)18-16(21)13-7-8-14(17)23-13/h2-9H,1H3,(H,18,21)
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n/an/a 1.80E+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, C...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2DV1HGT
More data for this
Ligand-Target Pair
Hematopoietic cell protein-tyrosine phosphatase 70Z-PEP


(Homo sapiens (Human))
BDBM76022
PNG
(5-bromanyl-N-[4-(6-methoxypyridazin-3-yl)phenyl]fu...)
Show SMILES COc1ccc(nn1)-c1ccc(NC(=O)c2ccc(Br)o2)cc1
Show InChI InChI=1S/C16H12BrN3O3/c1-22-15-9-6-12(19-20-15)10-2-4-11(5-3-10)18-16(21)13-7-8-14(17)23-13/h2-9H,1H3,(H,18,21)
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n/an/a 7.41E+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, C...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2FQ9V6B
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 11


(Homo sapiens (Human))
BDBM76022
PNG
(5-bromanyl-N-[4-(6-methoxypyridazin-3-yl)phenyl]fu...)
Show SMILES COc1ccc(nn1)-c1ccc(NC(=O)c2ccc(Br)o2)cc1
Show InChI InChI=1S/C16H12BrN3O3/c1-22-15-9-6-12(19-20-15)10-2-4-11(5-3-10)18-16(21)13-7-8-14(17)23-13/h2-9H,1H3,(H,18,21)
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n/an/a 4.30E+3n/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, C...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2T43RPN
More data for this
Ligand-Target Pair
tyrosine-protein phosphatase non-receptor type 5 isoform a


(Homo sapiens (Human))
BDBM76022
PNG
(5-bromanyl-N-[4-(6-methoxypyridazin-3-yl)phenyl]fu...)
Show SMILES COc1ccc(nn1)-c1ccc(NC(=O)c2ccc(Br)o2)cc1
Show InChI InChI=1S/C16H12BrN3O3/c1-22-15-9-6-12(19-20-15)10-2-4-11(5-3-10)18-16(21)13-7-8-14(17)23-13/h2-9H,1H3,(H,18,21)
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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, C...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2KH0KWR
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (Human))
BDBM76022
PNG
(5-bromanyl-N-[4-(6-methoxypyridazin-3-yl)phenyl]fu...)
Show SMILES COc1ccc(nn1)-c1ccc(NC(=O)c2ccc(Br)o2)cc1
Show InChI InChI=1S/C16H12BrN3O3/c1-22-15-9-6-12(19-20-15)10-2-4-11(5-3-10)18-16(21)13-7-8-14(17)23-13/h2-9H,1H3,(H,18,21)
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n/an/a 6.60E+3n/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, C...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2959G44
More data for this
Ligand-Target Pair