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BDBM263994 2-{5-[(2-fluorobenzyl)oxy]-1H- pyrazol-1-yl}pyridine-4- carboxylic acid::US10173996, Example 59::US9604961, Example 59::US9714230, 59::US9908865, Example 59

SMILES: OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F

InChI Key: InChIKey=VICDONOMNXVSDL-UHFFFAOYSA-N

Data: 14 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 14 hits for monomerid = 263994   
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
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM263994
PNG
(2-{5-[(2-fluorobenzyl)oxy]-1H- pyrazol-1-yl}pyridi...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F
Show InChI InChI=1S/C16H12FN3O3/c17-13-4-2-1-3-12(13)10-23-15-6-8-19-20(15)14-9-11(16(21)22)5-7-18-14/h1-9H,10H2,(H,21,22)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9714230 (2017)


BindingDB Entry DOI: 10.7270/Q2CR5WC6
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM263994
PNG
(2-{5-[(2-fluorobenzyl)oxy]-1H- pyrazol-1-yl}pyridi...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F
Show InChI InChI=1S/C16H12FN3O3/c17-13-4-2-1-3-12(13)10-23-15-6-8-19-20(15)14-9-11(16(21)22)5-7-18-14/h1-9H,10H2,(H,21,22)
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n/an/a<100n/an/an/an/an/a25



Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9714230 (2017)


BindingDB Entry DOI: 10.7270/Q2CR5WC6
More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM263994
PNG
(2-{5-[(2-fluorobenzyl)oxy]-1H- pyrazol-1-yl}pyridi...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F
Show InChI InChI=1S/C16H12FN3O3/c17-13-4-2-1-3-12(13)10-23-15-6-8-19-20(15)14-9-11(16(21)22)5-7-18-14/h1-9H,10H2,(H,21,22)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9714230 (2017)


BindingDB Entry DOI: 10.7270/Q2CR5WC6
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM263994
PNG
(2-{5-[(2-fluorobenzyl)oxy]-1H- pyrazol-1-yl}pyridi...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F
Show InChI InChI=1S/C16H12FN3O3/c17-13-4-2-1-3-12(13)10-23-15-6-8-19-20(15)14-9-11(16(21)22)5-7-18-14/h1-9H,10H2,(H,21,22)
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Celgene Quanticel Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9604961 (2017)


BindingDB Entry DOI: 10.7270/Q2KP847M
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM263994
PNG
(2-{5-[(2-fluorobenzyl)oxy]-1H- pyrazol-1-yl}pyridi...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F
Show InChI InChI=1S/C16H12FN3O3/c17-13-4-2-1-3-12(13)10-23-15-6-8-19-20(15)14-9-11(16(21)22)5-7-18-14/h1-9H,10H2,(H,21,22)
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n/an/a<10n/an/an/an/an/an/a



Celgene Quanticel Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9604961 (2017)


BindingDB Entry DOI: 10.7270/Q2KP847M
More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM263994
PNG
(2-{5-[(2-fluorobenzyl)oxy]-1H- pyrazol-1-yl}pyridi...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F
Show InChI InChI=1S/C16H12FN3O3/c17-13-4-2-1-3-12(13)10-23-15-6-8-19-20(15)14-9-11(16(21)22)5-7-18-14/h1-9H,10H2,(H,21,22)
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Celgene Quanticel Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9604961 (2017)


BindingDB Entry DOI: 10.7270/Q2KP847M
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM263994
PNG
(2-{5-[(2-fluorobenzyl)oxy]-1H- pyrazol-1-yl}pyridi...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F
Show InChI InChI=1S/C16H12FN3O3/c17-13-4-2-1-3-12(13)10-23-15-6-8-19-20(15)14-9-11(16(21)22)5-7-18-14/h1-9H,10H2,(H,21,22)
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n/an/a 42n/an/an/an/an/an/a



Celgene Corporation

Curated by ChEMBL


Assay Description
Inhibition of KDM5B (unknown origin) preincubated with enzyme


Bioorg Med Chem Lett 28: 1490-1494 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.083
BindingDB Entry DOI: 10.7270/Q26Q20W4
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM263994
PNG
(2-{5-[(2-fluorobenzyl)oxy]-1H- pyrazol-1-yl}pyridi...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F
Show InChI InChI=1S/C16H12FN3O3/c17-13-4-2-1-3-12(13)10-23-15-6-8-19-20(15)14-9-11(16(21)22)5-7-18-14/h1-9H,10H2,(H,21,22)
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n/an/a<100n/an/an/an/an/an/a



Celgene Quanticel Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US10173996 (2019)


BindingDB Entry DOI: 10.7270/Q2CJ8GK0
More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM263994
PNG
(2-{5-[(2-fluorobenzyl)oxy]-1H- pyrazol-1-yl}pyridi...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F
Show InChI InChI=1S/C16H12FN3O3/c17-13-4-2-1-3-12(13)10-23-15-6-8-19-20(15)14-9-11(16(21)22)5-7-18-14/h1-9H,10H2,(H,21,22)
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n/an/a<100n/an/an/an/an/an/a



Celgene Quanticel Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US10173996 (2019)


BindingDB Entry DOI: 10.7270/Q2CJ8GK0
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM263994
PNG
(2-{5-[(2-fluorobenzyl)oxy]-1H- pyrazol-1-yl}pyridi...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F
Show InChI InChI=1S/C16H12FN3O3/c17-13-4-2-1-3-12(13)10-23-15-6-8-19-20(15)14-9-11(16(21)22)5-7-18-14/h1-9H,10H2,(H,21,22)
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n/an/a<100n/an/an/an/an/an/a



The Scripps Research Institute



Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


J Med Chem 50: 3359-68 (2007)


BindingDB Entry DOI: 10.7270/Q29Z9762
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM263994
PNG
(2-{5-[(2-fluorobenzyl)oxy]-1H- pyrazol-1-yl}pyridi...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F
Show InChI InChI=1S/C16H12FN3O3/c17-13-4-2-1-3-12(13)10-23-15-6-8-19-20(15)14-9-11(16(21)22)5-7-18-14/h1-9H,10H2,(H,21,22)
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n/an/a<100n/an/an/an/an/an/a



The Scripps Research Institute



Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


J Med Chem 50: 3359-68 (2007)


BindingDB Entry DOI: 10.7270/Q29Z9762
More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM263994
PNG
(2-{5-[(2-fluorobenzyl)oxy]-1H- pyrazol-1-yl}pyridi...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F
Show InChI InChI=1S/C16H12FN3O3/c17-13-4-2-1-3-12(13)10-23-15-6-8-19-20(15)14-9-11(16(21)22)5-7-18-14/h1-9H,10H2,(H,21,22)
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n/an/a<100n/an/an/an/an/an/a



The Scripps Research Institute



Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


J Med Chem 50: 3359-68 (2007)


BindingDB Entry DOI: 10.7270/Q29Z9762
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM263994
PNG
(2-{5-[(2-fluorobenzyl)oxy]-1H- pyrazol-1-yl}pyridi...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F
Show InChI InChI=1S/C16H12FN3O3/c17-13-4-2-1-3-12(13)10-23-15-6-8-19-20(15)14-9-11(16(21)22)5-7-18-14/h1-9H,10H2,(H,21,22)
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Celgene Corporation

Curated by ChEMBL


Assay Description
Inhibition of KDM5A (unknown origin) preincubated with enzyme


Bioorg Med Chem Lett 28: 1490-1494 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.083
BindingDB Entry DOI: 10.7270/Q26Q20W4
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM263994
PNG
(2-{5-[(2-fluorobenzyl)oxy]-1H- pyrazol-1-yl}pyridi...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F
Show InChI InChI=1S/C16H12FN3O3/c17-13-4-2-1-3-12(13)10-23-15-6-8-19-20(15)14-9-11(16(21)22)5-7-18-14/h1-9H,10H2,(H,21,22)
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Celgene Quanticel Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US10173996 (2019)


BindingDB Entry DOI: 10.7270/Q2CJ8GK0
More data for this
Ligand-Target Pair