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BDBM48122 5-bromanyl-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-6-oxidanylidene-pyran-3-carboxamide::5-bromo-6-keto-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)pyran-3-carboxamide::5-bromo-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-6-oxo-3-pyrancarboxamide::5-bromo-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-6-oxopyran-3-carboxamide::MLS000036865::SMR000037750::cid_661972

SMILES: Cc1c(NC(=O)c2coc(=O)c(Br)c2)c(=O)n(-c2ccccc2)n1C

InChI Key: InChIKey=QTFUMERTTWGUSZ-UHFFFAOYSA-N

Data: 1 IC50  3 EC50

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 4 hits for monomerid = 48122   
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
matrix metalloproteinase 1


(Homo sapiens (Human))
BDBM48122
PNG
(5-bromanyl-N-(1,5-dimethyl-3-oxidanylidene-2-pheny...)
Show SMILES Cc1c(NC(=O)c2coc(=O)c(Br)c2)c(=O)n(-c2ccccc2)n1C
Show InChI InChI=1S/C17H14BrN3O4/c1-10-14(19-15(22)11-8-13(18)17(24)25-9-11)16(23)21(20(10)2)12-6-4-3-5-7-12/h3-9H,1-2H3,(H,19,22)
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 1.31E+4n/an/an/an/a



Sanford-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 (2008)


BindingDB Entry DOI: 10.7270/Q2154FGT
More data for this
Ligand-Target Pair
RecName: Full=Zinc finger protein mex-5


(Caenorhabditis elegans)
BDBM48122
PNG
(5-bromanyl-N-(1,5-dimethyl-3-oxidanylidene-2-pheny...)
Show SMILES Cc1c(NC(=O)c2coc(=O)c(Br)c2)c(=O)n(-c2ccccc2)n1C
Show InChI InChI=1S/C17H14BrN3O4/c1-10-14(19-15(22)11-8-13(18)17(24)25-9-11)16(23)21(20(10)2)12-6-4-3-5-7-12/h3-9H,1-2H3,(H,19,22)
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 1.69E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Broad Institute: MLPCN maternal gene expression Project ID: 2024 Keywords: Zinc finger, C. elegans, maternal gene expression, RNA-protein interac...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2D798VP
More data for this
Ligand-Target Pair
POsterior Segregation family member (pos-1)


(Caenorhabditis elegans)
BDBM48122
PNG
(5-bromanyl-N-(1,5-dimethyl-3-oxidanylidene-2-pheny...)
Show SMILES Cc1c(NC(=O)c2coc(=O)c(Br)c2)c(=O)n(-c2ccccc2)n1C
Show InChI InChI=1S/C17H14BrN3O4/c1-10-14(19-15(22)11-8-13(18)17(24)25-9-11)16(23)21(20(10)2)12-6-4-3-5-7-12/h3-9H,1-2H3,(H,19,22)
PDB

KEGG

UniProtKB/TrEMBL

GoogleScholar
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 8.99E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Broad Institute: MLPCN maternal gene expression Project ID: 2024 Keywords: Zinc finger, C. elegans, maternal gene expression, RNA-protein interac...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q28G8J4C
More data for this
Ligand-Target Pair
dTDP-4-dehydrorhamnose 3,5-epimerase RmlC


(Mycobacterium tuberculosis H37Rv)
BDBM48122
PNG
(5-bromanyl-N-(1,5-dimethyl-3-oxidanylidene-2-pheny...)
Show SMILES Cc1c(NC(=O)c2coc(=O)c(Br)c2)c(=O)n(-c2ccccc2)n1C
Show InChI InChI=1S/C17H14BrN3O4/c1-10-14(19-15(22)11-8-13(18)17(24)25-9-11)16(23)21(20(10)2)12-6-4-3-5-7-12/h3-9H,1-2H3,(H,19,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a 4.50E+3n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Michael McNeil, Colorado State Universi...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2TD9VRT
More data for this
Ligand-Target Pair