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Patent code US10174026

Compile Data Set for Download or QSAR

Found 297 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320444
PNG
(2-(2-1,2,3,4-tetrahydro- isoquinolylcarbonyl)pyrro...)
Show SMILES OC(=O)c1ccnc2cc([nH]c12)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C18H15N3O3/c22-17(21-8-6-11-3-1-2-4-12(11)10-21)15-9-14-16(20-15)13(18(23)24)5-7-19-14/h1-5,7,9,20H,6,8,10H2,(H,23,24)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320432
PNG
(2-(pyrrolidin-1-ylcarbonyl)-1H- pyrrolo[3,2-b]pyri...)
Show SMILES OC(=O)c1ccnc2cc([nH]c12)C(=O)N1CCCC1
Show InChI InChI=1S/C13H13N3O3/c17-12(16-5-1-2-6-16)10-7-9-11(15-10)8(13(18)19)3-4-14-9/h3-4,7,15H,1-2,5-6H2,(H,18,19)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320434
PNG
(2-[1-(4-fluorophenyl)-1- hydroxyethyl]-1H-pyrrolo[...)
Show SMILES CC(O)(c1cc2nccc(C(O)=O)c2[nH]1)c1ccc(F)cc1
Show InChI InChI=1S/C16H13FN2O3/c1-16(22,9-2-4-10(17)5-3-9)13-8-12-14(19-13)11(15(20)21)6-7-18-12/h2-8,19,22H,1H3,(H,20,21)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320436
PNG
(2- (indolinylcarbonyl)pyrrolo[3,2-b]- pyridine-7-c...)
Show SMILES OC(=O)c1ccnc2cc([nH]c12)C(=O)N1CCc2ccccc12
Show InChI InChI=1S/C17H13N3O3/c21-16(20-8-6-10-3-1-2-4-14(10)20)13-9-12-15(19-13)11(17(22)23)5-7-18-12/h1-5,7,9,19H,6,8H2,(H,22,23)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320446
PNG
(2-(3,4-difluorobenzyl)-1H- pyrrolo[3,2-b]pyridine-...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(F)c(F)c3)[nH]c12
Show InChI InChI=1S/C15H10F2N2O2/c16-11-2-1-8(6-12(11)17)5-9-7-13-14(19-9)10(15(20)21)3-4-18-13/h1-4,6-7,19H,5H2,(H,20,21)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320448
PNG
(2-(3,4-dichlorobenzyl)-1H- pyrrolo[3,2-b]pyridine-...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(Cl)c(Cl)c3)[nH]c12
Show InChI InChI=1S/C15H10Cl2N2O2/c16-11-2-1-8(6-12(11)17)5-9-7-13-14(19-9)10(15(20)21)3-4-18-13/h1-4,6-7,19H,5H2,(H,20,21)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320366
PNG
(2-propyl-1H-pyrrolo[3,2-b] pyridine-7-carboxylic a...)
Show SMILES CCCc1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C11H12N2O2/c1-2-3-7-6-9-10(13-7)8(11(14)15)4-5-12-9/h4-6,13H,2-3H2,1H3,(H,14,15)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320385
PNG
(2-cyclopentyl-1H-pyrrolo[3,2- b]pyridine-7-carboxy...)
Show SMILES OC(=O)c1ccnc2cc([nH]c12)C1CCCC1
Show InChI InChI=1S/C13H14N2O2/c16-13(17)9-5-6-14-11-7-10(15-12(9)11)8-3-1-2-4-8/h5-8,15H,1-4H2,(H,16,17)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320391
PNG
(2-[(3-methylphenyl)methyl]-1H- pyrrolo[3,2-b]pyrid...)
Show SMILES Cc1cccc(Cc2cc3nccc(C(O)=O)c3[nH]2)c1
Show InChI InChI=1S/C16H14N2O2/c1-10-3-2-4-11(7-10)8-12-9-14-15(18-12)13(16(19)20)5-6-17-14/h2-7,9,18H,8H2,1H3,(H,19,20)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320394
PNG
(2-(methoxymethyl)-1H- pyrrolo[3,2-b]pyridine-7- ca...)
Show SMILES COCc1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C10H10N2O3/c1-15-5-6-4-8-9(12-6)7(10(13)14)2-3-11-8/h2-4,12H,5H2,1H3,(H,13,14)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320404
PNG
(2-[(4-methoxyphenyl)methyl]- 1H-pyrrolo[3,2-b]pyri...)
Show SMILES COc1ccc(Cc2cc3nccc(C(O)=O)c3[nH]2)cc1
Show InChI InChI=1S/C16H14N2O3/c1-21-12-4-2-10(3-5-12)8-11-9-14-15(18-11)13(16(19)20)6-7-17-14/h2-7,9,18H,8H2,1H3,(H,19,20)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320405
PNG
(2-[(4-fluorophenoxy)methyl]-1H- pyrrolo[3,2-b]pyri...)
Show SMILES OC(=O)c1ccnc2cc(COc3ccc(F)cc3)[nH]c12
Show InChI InChI=1S/C15H11FN2O3/c16-9-1-3-11(4-2-9)21-8-10-7-13-14(18-10)12(15(19)20)5-6-17-13/h1-7,18H,8H2,(H,19,20)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320417
PNG
(2-[(3,5-difluorophenoxy)methyl]- 1H-pyrrolo[3,2-b]...)
Show SMILES OC(=O)c1ccnc2cc(COc3cc(F)cc(F)c3)[nH]c12
Show InChI InChI=1S/C15H10F2N2O3/c16-8-3-9(17)5-11(4-8)22-7-10-6-13-14(19-10)12(15(20)21)1-2-18-13/h1-6,19H,7H2,(H,20,21)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320420
PNG
(2-(1-phenoxyethyl)-1H- pyrrolo[3,2-b]pyridine-7- c...)
Show SMILES CC(Oc1ccccc1)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C16H14N2O3/c1-10(21-11-5-3-2-4-6-11)13-9-14-15(18-13)12(16(19)20)7-8-17-14/h2-10,18H,1H3,(H,19,20)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320423
PNG
(2-[(2-chlorophenyl)-propoxy- methyl]-1H-pyrrolo[3,...)
Show SMILES CCCOC(c1cc2nccc(C(O)=O)c2[nH]1)c1ccccc1Cl
Show InChI InChI=1S/C18H17ClN2O3/c1-2-9-24-17(11-5-3-4-6-13(11)19)15-10-14-16(21-15)12(18(22)23)7-8-20-14/h3-8,10,17,21H,2,9H2,1H3,(H,22,23)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320439
PNG
(2-(3-chloro-4-fluorobenzyl)-1H- pyrrolo[3,2-b]pyri...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(F)c(Cl)c3)[nH]c12
Show InChI InChI=1S/C15H10ClFN2O2/c16-11-6-8(1-2-12(11)17)5-9-7-13-14(19-9)10(15(20)21)3-4-18-13/h1-4,6-7,19H,5H2,(H,20,21)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320450
PNG
(2-(4-chloro-3-methylbenzyl)-1H- pyrrolo[3,2-b]pyri...)
Show SMILES Cc1cc(Cc2cc3nccc(C(O)=O)c3[nH]2)ccc1Cl
Show InChI InChI=1S/C16H13ClN2O2/c1-9-6-10(2-3-13(9)17)7-11-8-14-15(19-11)12(16(20)21)4-5-18-14/h2-6,8,19H,7H2,1H3,(H,20,21)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320379
PNG
(2-[hydroxy-(3-methyl- phenyl)methyl]-1H-pyrrolo[3,...)
Show SMILES Cc1cccc(c1)C(O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C16H14N2O3/c1-9-3-2-4-10(7-9)15(19)13-8-12-14(18-13)11(16(20)21)5-6-17-12/h2-8,15,18-19H,1H3,(H,20,21)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320390
PNG
(2-[(3-methoxyphenyl)methyl]- 1H-pyrrolo[3,2-b]pyri...)
Show SMILES COc1cccc(Cc2cc3nccc(C(O)=O)c3[nH]2)c1
Show InChI InChI=1S/C16H14N2O3/c1-21-12-4-2-3-10(8-12)7-11-9-14-15(18-11)13(16(19)20)5-6-17-14/h2-6,8-9,18H,7H2,1H3,(H,19,20)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320393
PNG
(2-(phenoxymethyl)-1H- pyrrolo[3,2-b]pyridine-7- ca...)
Show SMILES OC(=O)c1ccnc2cc(COc3ccccc3)[nH]c12
Show InChI InChI=1S/C15H12N2O3/c18-15(19)12-6-7-16-13-8-10(17-14(12)13)9-20-11-4-2-1-3-5-11/h1-8,17H,9H2,(H,18,19)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320398
PNG
(2-[hydroxy-(2-methylpyrazol-3- yl)methyl]-1H-pyrro...)
Show SMILES Cn1nccc1C(O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C13H12N4O3/c1-17-10(3-5-15-17)12(18)9-6-8-11(16-9)7(13(19)20)2-4-14-8/h2-6,12,16,18H,1H3,(H,19,20)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320398
PNG
(2-[hydroxy-(2-methylpyrazol-3- yl)methyl]-1H-pyrro...)
Show SMILES Cn1nccc1C(O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C13H12N4O3/c1-17-10(3-5-15-17)12(18)9-6-8-11(16-9)7(13(19)20)2-4-14-8/h2-6,12,16,18H,1H3,(H,19,20)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320399
PNG
(2-(cyclopentylmethyl)-1H- pyrrolo[3,2-b]pyridine- ...)
Show SMILES OC(=O)c1ccnc2cc(CC3CCCC3)[nH]c12
Show InChI InChI=1S/C14H16N2O2/c17-14(18)11-5-6-15-12-8-10(16-13(11)12)7-9-3-1-2-4-9/h5-6,8-9,16H,1-4,7H2,(H,17,18)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320400
PNG
(2-(cyclohexylmethyl)-1H- pyrrolo[3,2-b]pyridine-7-...)
Show SMILES OC(=O)c1ccnc2cc(CC3CCCCC3)[nH]c12
Show InChI InChI=1S/C15H18N2O2/c18-15(19)12-6-7-16-13-9-11(17-14(12)13)8-10-4-2-1-3-5-10/h6-7,9-10,17H,1-5,8H2,(H,18,19)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320408
PNG
(2-[(2-methylphenoxy)methyl]- 1H-pyrrolo[3,2-b]pyri...)
Show SMILES Cc1ccccc1OCc1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C16H14N2O3/c1-10-4-2-3-5-14(10)21-9-11-8-13-15(18-11)12(16(19)20)6-7-17-13/h2-8,18H,9H2,1H3,(H,19,20)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320410
PNG
(2-(2-phenylethyl)-1H- pyrrolo[3,2-b]pyridine-7- ca...)
Show SMILES OC(=O)c1ccnc2cc(CCc3ccccc3)[nH]c12
Show InChI InChI=1S/C16H14N2O2/c19-16(20)13-8-9-17-14-10-12(18-15(13)14)7-6-11-4-2-1-3-5-11/h1-5,8-10,18H,6-7H2,(H,19,20)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320421
PNG
(2-(1-phenoxybutyl)-1H- pyrrolo[3,2-b]pyridine-7- c...)
Show SMILES CCCC(Oc1ccccc1)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C18H18N2O3/c1-2-6-16(23-12-7-4-3-5-8-12)14-11-15-17(20-14)13(18(21)22)9-10-19-15/h3-5,7-11,16,20H,2,6H2,1H3,(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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320432
PNG
(2-(pyrrolidin-1-ylcarbonyl)-1H- pyrrolo[3,2-b]pyri...)
Show SMILES OC(=O)c1ccnc2cc([nH]c12)C(=O)N1CCCC1
Show InChI InChI=1S/C13H13N3O3/c17-12(16-5-1-2-6-16)10-7-9-11(15-10)8(13(18)19)3-4-14-9/h3-4,7,15H,1-2,5-6H2,(H,18,19)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320447
PNG
(2-(4-chloro-3-methoxybenzyl)- 1H-pyrrolo[3,2-b]pyr...)
Show SMILES COc1cc(Cc2cc3nccc(C(O)=O)c3[nH]2)ccc1Cl
Show InChI InChI=1S/C16H13ClN2O3/c1-22-14-7-9(2-3-12(14)17)6-10-8-13-15(19-10)11(16(20)21)4-5-18-13/h2-5,7-8,19H,6H2,1H3,(H,20,21)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320452
PNG
(2-[4-chloro-3-(cyclopropyl- methoxy)benzyl]-1H-pyr...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(Cl)c(OCC4CC4)c3)[nH]c12
Show InChI InChI=1S/C19H17ClN2O3/c20-15-4-3-12(8-17(15)25-10-11-1-2-11)7-13-9-16-18(22-13)14(19(23)24)5-6-21-16/h3-6,8-9,11,22H,1-2,7,10H2,(H,23,24)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320369
PNG
(2-cyclopropyl-1H-pyrrolo- [3,2-b]pyridine-7-carbox...)
Show SMILES OC(=O)c1ccnc2cc([nH]c12)C1CC1
Show InChI InChI=1S/C11H10N2O2/c14-11(15)7-3-4-12-9-5-8(6-1-2-6)13-10(7)9/h3-6,13H,1-2H2,(H,14,15)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320376
PNG
(2-(1-hydroxyethyl)-1H- pyrrolo[3,2-b]pyridine-7- c...)
Show SMILES CC(O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C10H10N2O3/c1-5(13)7-4-8-9(12-7)6(10(14)15)2-3-11-8/h2-5,12-13H,1H3,(H,14,15)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320378
PNG
(2-[hydroxy(phenyl)methyl]-1H- pyrrolo[3,2-b]pyridi...)
Show SMILES OC(c1cc2nccc(C(O)=O)c2[nH]1)c1ccccc1
Show InChI InChI=1S/C15H12N2O3/c18-14(9-4-2-1-3-5-9)12-8-11-13(17-12)10(15(19)20)6-7-16-11/h1-8,14,17-18H,(H,19,20)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320378
PNG
(2-[hydroxy(phenyl)methyl]-1H- pyrrolo[3,2-b]pyridi...)
Show SMILES OC(c1cc2nccc(C(O)=O)c2[nH]1)c1ccccc1
Show InChI InChI=1S/C15H12N2O3/c18-14(9-4-2-1-3-5-9)12-8-11-13(17-12)10(15(19)20)6-7-16-11/h1-8,14,17-18H,(H,19,20)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320389
PNG
(2-[cyclopropyl(hydroxy)methyl]- 1H-pyrrolo[3,2-b]p...)
Show SMILES OC(C1CC1)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C12H12N2O3/c15-11(6-1-2-6)9-5-8-10(14-9)7(12(16)17)3-4-13-8/h3-6,11,14-15H,1-2H2,(H,16,17)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320389
PNG
(2-[cyclopropyl(hydroxy)methyl]- 1H-pyrrolo[3,2-b]p...)
Show SMILES OC(C1CC1)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C12H12N2O3/c15-11(6-1-2-6)9-5-8-10(14-9)7(12(16)17)3-4-13-8/h3-6,11,14-15H,1-2H2,(H,16,17)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320412
PNG
(2-[(3-methylphenoxy)methyl]- 1H-pyrrolo[3,2-b]pyri...)
Show SMILES Cc1cccc(OCc2cc3nccc(C(O)=O)c3[nH]2)c1
Show InChI InChI=1S/C16H14N2O3/c1-10-3-2-4-12(7-10)21-9-11-8-14-15(18-11)13(16(19)20)5-6-17-14/h2-8,18H,9H2,1H3,(H,19,20)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320413
PNG
(2-(2,3-dihydro-1-benzofuran-5- yloxymethyl)-1H-pyr...)
Show SMILES OC(=O)c1ccnc2cc(COc3ccc4OCCc4c3)[nH]c12
Show InChI InChI=1S/C17H14N2O4/c20-17(21)13-3-5-18-14-8-11(19-16(13)14)9-23-12-1-2-15-10(7-12)4-6-22-15/h1-3,5,7-8,19H,4,6,9H2,(H,20,21)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320415
PNG
(2-[(3-fluorophenoxy)methyl]-1H- pyrrolo[3,2-b]pyri...)
Show SMILES OC(=O)c1ccnc2cc(COc3cccc(F)c3)[nH]c12
Show InChI InChI=1S/C15H11FN2O3/c16-9-2-1-3-11(6-9)21-8-10-7-13-14(18-10)12(15(19)20)4-5-17-13/h1-7,18H,8H2,(H,19,20)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320417
PNG
(2-[(3,5-difluorophenoxy)methyl]- 1H-pyrrolo[3,2-b]...)
Show SMILES OC(=O)c1ccnc2cc(COc3cc(F)cc(F)c3)[nH]c12
Show InChI InChI=1S/C15H10F2N2O3/c16-8-3-9(17)5-11(4-8)22-7-10-6-13-14(19-10)12(15(20)21)1-2-18-13/h1-6,19H,7H2,(H,20,21)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320418
PNG
(2-[(3,5-dimethylphenoxy)- methyl]-1H-pyrrolo[3,2-b...)
Show SMILES Cc1cc(C)cc(OCc2cc3nccc(C(O)=O)c3[nH]2)c1
Show InChI InChI=1S/C17H16N2O3/c1-10-5-11(2)7-13(6-10)22-9-12-8-15-16(19-12)14(17(20)21)3-4-18-15/h3-8,19H,9H2,1-2H3,(H,20,21)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320419
PNG
(2-[(3,5-dichlorophenoxy)methyl]- 1H-pyrrolo[3,2-b]...)
Show SMILES OC(=O)c1ccnc2cc(COc3cc(Cl)cc(Cl)c3)[nH]c12
Show InChI InChI=1S/C15H10Cl2N2O3/c16-8-3-9(17)5-11(4-8)22-7-10-6-13-14(19-10)12(15(20)21)1-2-18-13/h1-6,19H,7H2,(H,20,21)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320420
PNG
(2-(1-phenoxyethyl)-1H- pyrrolo[3,2-b]pyridine-7- c...)
Show SMILES CC(Oc1ccccc1)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C16H14N2O3/c1-10(21-11-5-3-2-4-6-11)13-9-14-15(18-13)12(16(19)20)7-8-17-14/h2-10,18H,1H3,(H,19,20)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320424
PNG
(2-[(2,4-dichlorophenyl)methyl]- 1H-pyrrolo[3,2-b]p...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(Cl)cc3Cl)[nH]c12
Show InChI InChI=1S/C15H10Cl2N2O2/c16-9-2-1-8(12(17)6-9)5-10-7-13-14(19-10)11(15(20)21)3-4-18-13/h1-4,6-7,19H,5H2,(H,20,21)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4A


(Homo sapiens (Human))
BDBM320432
PNG
(2-(pyrrolidin-1-ylcarbonyl)-1H- pyrrolo[3,2-b]pyri...)
Show SMILES OC(=O)c1ccnc2cc([nH]c12)C(=O)N1CCCC1
Show InChI InChI=1S/C13H13N3O3/c17-12(16-5-1-2-6-16)10-7-9-11(15-10)8(13(18)19)3-4-14-9/h3-4,7,15H,1-2,5-6H2,(H,18,19)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320439
PNG
(2-(3-chloro-4-fluorobenzyl)-1H- pyrrolo[3,2-b]pyri...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(F)c(Cl)c3)[nH]c12
Show InChI InChI=1S/C15H10ClFN2O2/c16-11-6-8(1-2-12(11)17)5-9-7-13-14(19-9)10(15(20)21)3-4-18-13/h1-4,6-7,19H,5H2,(H,20,21)
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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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320440
PNG
(2-(4-chloro-3-fluorobenzyl)-1H- pyrrolo[3,2-b]pyri...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(Cl)c(F)c3)[nH]c12
Show InChI InChI=1S/C15H10ClFN2O2/c16-11-2-1-8(6-12(11)17)5-9-7-13-14(19-9)10(15(20)21)3-4-18-13/h1-4,6-7,19H,5H2,(H,20,21)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320441
PNG
(2-[(3-phenylpyrrolidinyl)- carbonyl]pyrrolo[3,2-b]...)
Show SMILES OC(=O)c1ccnc2cc([nH]c12)C(=O)N1CCC(C1)c1ccccc1
Show InChI InChI=1S/C19H17N3O3/c23-18(22-9-7-13(11-22)12-4-2-1-3-5-12)16-10-15-17(21-16)14(19(24)25)6-8-20-15/h1-6,8,10,13,21H,7,9,11H2,(H,24,25)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
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PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320445
PNG
(2-[(2,2-dimethylpyrrolidinyl)- carbonyl]pyrrolo[3,...)
Show SMILES CC1(C)CCCN1C(=O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C15H17N3O3/c1-15(2)5-3-7-18(15)13(19)11-8-10-12(17-11)9(14(20)21)4-6-16-10/h4,6,8,17H,3,5,7H2,1-2H3,(H,20,21)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
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 US10174026 (2019)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320370
PNG
(2-(2-hydroxypropan-2-yl)-1H- pyrrolo[3,2-b]pyridin...)
Show SMILES CC(C)(O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C11H12N2O3/c1-11(2,16)8-5-7-9(13-8)6(10(14)15)3-4-12-7/h3-5,13,16H,1-2H3,(H,14,15)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
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 US10174026 (2019)

More data for this
Ligand-Target Pair
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* indicates data uncertainty>20%