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BDBM263944 2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonicotinic acid::US10173996, Example 14::US9604961, Example 14::US9714230, 14::US9908865, Example 14

SMILES: OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F

InChI Key: InChIKey=WTMJZFIQFSYVHA-UHFFFAOYSA-N

Data: 18 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 18 hits for monomerid = 263944   
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))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(H,21,22)
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n/an/a 550n/an/an/an/an/a25



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))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(H,21,22)
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n/an/a 170n/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 4C


(Homo sapiens (Human))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(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 4A


(Homo sapiens (Human))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(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 JMJD2A was determined in 384-well plate format under the following reaction conditions: 2 nM...


US Patent US9714230 (2017)


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


(Homo sapiens (Human))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(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))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(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 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))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(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
jmjd2a


(Homo sapiens (Human))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(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 JMJD2A was determined in 384-well plate format under the following reaction conditions: 2 nM...


US Patent US9604961 (2017)


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


(Homo sapiens (Human))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(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
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(H,21,22)
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n/an/a 550n/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))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(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 US10173996 (2019)


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


(Homo sapiens (Human))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(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 JMJD2A was determined in 384-well plate format under the following reaction conditions: 2 nM...


US Patent US10173996 (2019)


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


(Homo sapiens (Human))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(H,21,22)
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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))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(H,21,22)
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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))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(H,21,22)
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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 4A


(Homo sapiens (Human))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(H,21,22)
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The Scripps Research Institute



Assay Description
The ability of test compounds to inhibit the activity of JMJD2A was determined in 38-well plate format under the following reaction conditions: 2 nM ...


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))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(H,21,22)
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Celgene Corporation

Curated by ChEMBL


Assay Description
Inhibition of KDM4C (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))
BDBM263944
PNG
(2-(5-(2,4-difluorophenyl)-1H- pyrazol-1-yl)isonico...)
Show SMILES OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
Show InChI InChI=1S/C15H9F2N3O2/c16-10-1-2-11(12(17)8-10)13-4-6-19-20(13)14-7-9(15(21)22)3-5-18-14/h1-8H,(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 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