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BDBM44450 (3,5-dimethylpyrazol-1-yl)methyl-[4-(trifluoromethyl)thiazol-2-yl]amine::MLS000085296::N-[(3,5-dimethyl-1-pyrazolyl)methyl]-4-(trifluoromethyl)-2-thiazolamine::N-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine::N-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine::SMR000020034::cid_3244409

SMILES: Cc1cc(C)n(CNc2nc(cs2)C(F)(F)F)n1

InChI Key: InChIKey=KCEKBUJLKKSISN-UHFFFAOYSA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 44450   
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
Ephrin type-A receptor 4


(Mus musculus)
BDBM44450
PNG
((3,5-dimethylpyrazol-1-yl)methyl-[4-(trifluorometh...)
Show SMILES Cc1cc(C)n(CNc2nc(cs2)C(F)(F)F)n1
Show InChI InChI=1S/C10H11F3N4S/c1-6-3-7(2)17(16-6)5-14-9-15-8(4-18-9)10(11,12)13/h3-4H,5H2,1-2H3,(H,14,15)
PDB
MMDB

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PCBioAssay
n/an/a>1.00E+5n/an/an/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/Q2P55KW4
More data for this
Ligand-Target Pair
Phosphomannomutase 2


(Homo sapiens (Human))
BDBM44450
PNG
((3,5-dimethylpyrazol-1-yl)methyl-[4-(trifluorometh...)
Show SMILES Cc1cc(C)n(CNc2nc(cs2)C(F)(F)F)n1
Show InChI InChI=1S/C10H11F3N4S/c1-6-3-7(2)17(16-6)5-14-9-15-8(4-18-9)10(11,12)13/h3-4H,5H2,1-2H3,(H,14,15)
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antibodypedia
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Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human purified PMM2


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
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM44450
PNG
((3,5-dimethylpyrazol-1-yl)methyl-[4-(trifluorometh...)
Show SMILES Cc1cc(C)n(CNc2nc(cs2)C(F)(F)F)n1
Show InChI InChI=1S/C10H11F3N4S/c1-6-3-7(2)17(16-6)5-14-9-15-8(4-18-9)10(11,12)13/h3-4H,5H2,1-2H3,(H,14,15)
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antibodypedia
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Article
PubMed
n/an/a 6.00E+3n/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
Ephrin type-A receptor 4


(Mus musculus)
BDBM44450
PNG
((3,5-dimethylpyrazol-1-yl)methyl-[4-(trifluorometh...)
Show SMILES Cc1cc(C)n(CNc2nc(cs2)C(F)(F)F)n1
Show InChI InChI=1S/C10H11F3N4S/c1-6-3-7(2)17(16-6)5-14-9-15-8(4-18-9)10(11,12)13/h3-4H,5H2,1-2H3,(H,14,15)
PDB
MMDB

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UniProtKB/SwissProt

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PC cid
PC sid
UniChem

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PCBioAssay
n/an/a>5.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2JD4V5T
More data for this
Ligand-Target Pair