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BDBM46672 2-(2,5-dimethylphenyl)-1H-indazol-3-one::2-(2,5-dimethylphenyl)indazolin-3-one::MLS-0315920.0001::cid_13947703

SMILES: Cc1ccc(C)c(c1)-n1[nH]c2ccccc2c1=O

InChI Key: InChIKey=WBELOCIENAAVCE-UHFFFAOYSA-N

Data: 3 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 46672   
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
phosphomannomutase 2


(Homo sapiens (Human))
BDBM46672
PNG
(2-(2,5-dimethylphenyl)-1H-indazol-3-one | 2-(2,5-d...)
Show SMILES Cc1ccc(C)c(c1)-n1[nH]c2ccccc2c1=O
Show InChI InChI=1S/C15H14N2O/c1-10-7-8-11(2)14(9-10)17-15(18)12-5-3-4-6-13(12)16-17/h3-9,16H,1-2H3
PDB
MMDB

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PCBioAssay
n/an/a>1.00E+5n/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 (2010)


BindingDB Entry DOI: 10.7270/Q2CJ8BWC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46672
PNG
(2-(2,5-dimethylphenyl)-1H-indazol-3-one | 2-(2,5-d...)
Show SMILES Cc1ccc(C)c(c1)-n1[nH]c2ccccc2c1=O
Show InChI InChI=1S/C15H14N2O/c1-10-7-8-11(2)14(9-10)17-15(18)12-5-3-4-6-13(12)16-17/h3-9,16H,1-2H3
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Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human purified phosphomannose isomerase


J Med Chem 54: 3661-8 (2011)


Article DOI: 10.1021/jm101401a
BindingDB Entry DOI: 10.7270/Q28C9WKP
More data for this
Ligand-Target Pair
MPI protein


(Homo sapiens (Human))
BDBM46672
PNG
(2-(2,5-dimethylphenyl)-1H-indazol-3-one | 2-(2,5-d...)
Show SMILES Cc1ccc(C)c(c1)-n1[nH]c2ccccc2c1=O
Show InChI InChI=1S/C15H14N2O/c1-10-7-8-11(2)14(9-10)17-15(18)12-5-3-4-6-13(12)16-17/h3-9,16H,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

PCBioAssay
n/an/a>1.00E+5n/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 (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair