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PubMed code 26226049

Compile data set for download or QSAR
Found 87 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
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105306
PNG
(CHEMBL3597782)
Show SMILES Fc1ccc(Br)c(F)c1[C@H]1C[C@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H11Br2F2N5/c17-9-3-1-2-8(6-9)12-7-13(25-16(21-12)22-23-24-25)14-11(19)5-4-10(18)15(14)20/h1-6,12-13H,7H2,(H,21,22,24)/t12-,13+/m0/s1
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n/an/a 32n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105310
PNG
(CHEMBL3597786)
Show SMILES Fc1cc(Br)cc(c1)[C@@H]1C[C@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H12Br2FN5/c17-11-3-1-2-9(4-11)15-8-14(20-16-21-22-23-24(15)16)10-5-12(18)7-13(19)6-10/h1-7,14-15H,8H2,(H,20,21,23)/t14-,15+/m0/s1
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n/an/a 43n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105280
PNG
(CHEMBL3597780)
Show SMILES Clc1ccc(Br)cc1[C@H]1C[C@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H12Br2ClN5/c17-10-3-1-2-9(6-10)14-8-15(24-16(20-14)21-22-23-24)12-7-11(18)4-5-13(12)19/h1-7,14-15H,8H2,(H,20,21,23)/t14-,15+/m0/s1
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n/an/a 87n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105308
PNG
(CHEMBL3597784)
Show SMILES Fc1cc(Br)cc(c1)[C@@H]1C[C@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13BrFN5/c17-12-6-11(7-13(18)8-12)14-9-15(10-4-2-1-3-5-10)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m0/s1
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n/an/a 97n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105278
PNG
(CHEMBL3597778)
Show SMILES Brc1cccc(c1)[C@@H]1C[C@H](c2cccc(I)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13BrIN5/c17-12-5-1-3-10(7-12)14-9-15(11-4-2-6-13(18)8-11)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m0/s1
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n/an/a 108n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105276
PNG
(CHEMBL3597698)
Show SMILES Brc1cccc(c1)[C@@H]1C[C@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13Br2N5/c17-12-5-1-3-10(7-12)14-9-15(11-4-2-6-13(18)8-11)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m0/s1
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n/an/a 112n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105274
PNG
(CHEMBL3597696)
Show SMILES Clc1ccccc1[C@H]1C[C@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H13BrClN5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m0/s1
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n/an/a 195n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105268
PNG
(CHEMBL3597690)
Show SMILES Brc1cccc(c1)[C@@H]1C[C@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H14BrN5/c17-13-8-4-7-12(9-13)14-10-15(11-5-2-1-3-6-11)22-16(18-14)19-20-21-22/h1-9,14-15H,10H2,(H,18,19,21)/t14-,15+/m0/s1
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n/an/a 248n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105272
PNG
(CHEMBL3597694)
Show SMILES Brc1cccc(c1)[C@@H]1C[C@H](c2ccccc2Br)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13Br2N5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m0/s1
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n/an/a 314n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105310
PNG
(CHEMBL3597786)
Show SMILES Fc1cc(Br)cc(c1)[C@@H]1C[C@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H12Br2FN5/c17-11-3-1-2-9(4-11)15-8-14(20-16-21-22-23-24(15)16)10-5-12(18)7-13(19)6-10/h1-7,14-15H,8H2,(H,20,21,23)/t14-,15+/m0/s1
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n/an/a<1.00E+3n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Inhibition of HIF-2alpha in human Hep3B cells assessed as downregulation of EPO mRNA expression by RT-PCR analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105270
PNG
(CHEMBL3597692)
Show SMILES Ic1cccc(c1)[C@@H]1C[C@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H14IN5/c17-13-8-4-7-12(9-13)14-10-15(11-5-2-1-3-6-11)22-16(18-14)19-20-21-22/h1-9,14-15H,10H2,(H,18,19,21)/t14-,15+/m0/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105308
PNG
(CHEMBL3597784)
Show SMILES Fc1cc(Br)cc(c1)[C@@H]1C[C@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13BrFN5/c17-12-6-11(7-13(18)8-12)14-9-15(10-4-2-1-3-5-10)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m0/s1
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n/an/a 1.01E+4n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105274
PNG
(CHEMBL3597696)
Show SMILES Clc1ccccc1[C@H]1C[C@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H13BrClN5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m0/s1
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n/an/a 1.59E+4n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105307
PNG
(CHEMBL3597783)
Show SMILES Fc1ccc(Br)c(F)c1[C@@H]1C[C@@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H11Br2F2N5/c17-9-3-1-2-8(6-9)12-7-13(25-16(21-12)22-23-24-25)14-11(19)5-4-10(18)15(14)20/h1-6,12-13H,7H2,(H,21,22,24)/t12-,13+/m1/s1
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n/an/a 2.23E+4n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105280
PNG
(CHEMBL3597780)
Show SMILES Clc1ccc(Br)cc1[C@H]1C[C@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H12Br2ClN5/c17-10-3-1-2-9(6-10)14-8-15(24-16(20-14)21-22-23-24)12-7-11(18)4-5-13(12)19/h1-7,14-15H,8H2,(H,20,21,23)/t14-,15+/m0/s1
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n/an/a 2.39E+4n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105273
PNG
(CHEMBL3597695)
Show SMILES Brc1cccc(c1)[C@H]1C[C@@H](c2ccccc2Br)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13Br2N5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m1/s1
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n/an/a 2.83E+4n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105309
PNG
(CHEMBL3597785)
Show SMILES Fc1cc(Br)cc(c1)[C@H]1C[C@@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13BrFN5/c17-12-6-11(7-13(18)8-12)14-9-15(10-4-2-1-3-5-10)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105271
PNG
(CHEMBL3597693)
Show SMILES Ic1cccc(c1)[C@H]1C[C@@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H14IN5/c17-13-8-4-7-12(9-13)14-10-15(11-5-2-1-3-6-11)22-16(18-14)19-20-21-22/h1-9,14-15H,10H2,(H,18,19,21)/t14-,15+/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105304
PNG
(CHEMBL3597781)
Show SMILES Clc1ccc(Br)cc1[C@@H]1C[C@@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H12Br2ClN5/c17-10-3-1-2-9(6-10)14-8-15(24-16(20-14)21-22-23-24)12-7-11(18)4-5-13(12)19/h1-7,14-15H,8H2,(H,20,21,23)/t14-,15+/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105277
PNG
(CHEMBL3597699)
Show SMILES Brc1cccc(c1)[C@H]1C[C@@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13Br2N5/c17-12-5-1-3-10(7-12)14-9-15(11-4-2-6-13(18)8-11)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m1/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105304
PNG
(CHEMBL3597781)
Show SMILES Clc1ccc(Br)cc1[C@@H]1C[C@@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H12Br2ClN5/c17-10-3-1-2-9(6-10)14-8-15(24-16(20-14)21-22-23-24)12-7-11(18)4-5-13(12)19/h1-7,14-15H,8H2,(H,20,21,23)/t14-,15+/m1/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105268
PNG
(CHEMBL3597690)
Show SMILES Brc1cccc(c1)[C@@H]1C[C@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H14BrN5/c17-13-8-4-7-12(9-13)14-10-15(11-5-2-1-3-6-11)22-16(18-14)19-20-21-22/h1-9,14-15H,10H2,(H,18,19,21)/t14-,15+/m0/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105269
PNG
(CHEMBL3597691)
Show SMILES Brc1cccc(c1)[C@H]1C[C@@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H14BrN5/c17-13-8-4-7-12(9-13)14-10-15(11-5-2-1-3-6-11)22-16(18-14)19-20-21-22/h1-9,14-15H,10H2,(H,18,19,21)/t14-,15+/m1/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105270
PNG
(CHEMBL3597692)
Show SMILES Ic1cccc(c1)[C@@H]1C[C@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H14IN5/c17-13-8-4-7-12(9-13)14-10-15(11-5-2-1-3-6-11)22-16(18-14)19-20-21-22/h1-9,14-15H,10H2,(H,18,19,21)/t14-,15+/m0/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105312
PNG
(CHEMBL3597787)
Show SMILES Fc1cc(Br)cc(c1)[C@H]1C[C@@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H12Br2FN5/c17-11-3-1-2-9(4-11)15-8-14(20-16-21-22-23-24(15)16)10-5-12(18)7-13(19)6-10/h1-7,14-15H,8H2,(H,20,21,23)/t14-,15+/m1/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105276
PNG
(CHEMBL3597698)
Show SMILES Brc1cccc(c1)[C@@H]1C[C@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13Br2N5/c17-12-5-1-3-10(7-12)14-9-15(11-4-2-6-13(18)8-11)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m0/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105271
PNG
(CHEMBL3597693)
Show SMILES Ic1cccc(c1)[C@H]1C[C@@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H14IN5/c17-13-8-4-7-12(9-13)14-10-15(11-5-2-1-3-6-11)22-16(18-14)19-20-21-22/h1-9,14-15H,10H2,(H,18,19,21)/t14-,15+/m1/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105277
PNG
(CHEMBL3597699)
Show SMILES Brc1cccc(c1)[C@H]1C[C@@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13Br2N5/c17-12-5-1-3-10(7-12)14-9-15(11-4-2-6-13(18)8-11)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m1/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105269
PNG
(CHEMBL3597691)
Show SMILES Brc1cccc(c1)[C@H]1C[C@@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H14BrN5/c17-13-8-4-7-12(9-13)14-10-15(11-5-2-1-3-6-11)22-16(18-14)19-20-21-22/h1-9,14-15H,10H2,(H,18,19,21)/t14-,15+/m1/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105273
PNG
(CHEMBL3597695)
Show SMILES Brc1cccc(c1)[C@H]1C[C@@H](c2ccccc2Br)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13Br2N5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m1/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105279
PNG
(CHEMBL3597779)
Show SMILES Brc1cccc(c1)[C@H]1C[C@@H](c2cccc(I)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13BrIN5/c17-12-5-1-3-10(7-12)14-9-15(11-4-2-6-13(18)8-11)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m1/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105312
PNG
(CHEMBL3597787)
Show SMILES Fc1cc(Br)cc(c1)[C@H]1C[C@@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H12Br2FN5/c17-11-3-1-2-9(4-11)15-8-14(20-16-21-22-23-24(15)16)10-5-12(18)7-13(19)6-10/h1-7,14-15H,8H2,(H,20,21,23)/t14-,15+/m1/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105307
PNG
(CHEMBL3597783)
Show SMILES Fc1ccc(Br)c(F)c1[C@@H]1C[C@@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H11Br2F2N5/c17-9-3-1-2-8(6-9)12-7-13(25-16(21-12)22-23-24-25)14-11(19)5-4-10(18)15(14)20/h1-6,12-13H,7H2,(H,21,22,24)/t12-,13+/m1/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105309
PNG
(CHEMBL3597785)
Show SMILES Fc1cc(Br)cc(c1)[C@H]1C[C@@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13BrFN5/c17-12-6-11(7-13(18)8-12)14-9-15(10-4-2-1-3-5-10)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m1/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105275
PNG
(CHEMBL3597697)
Show SMILES Clc1ccccc1[C@@H]1C[C@@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H13BrClN5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m1/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105278
PNG
(CHEMBL3597778)
Show SMILES Brc1cccc(c1)[C@@H]1C[C@H](c2cccc(I)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13BrIN5/c17-12-5-1-3-10(7-12)14-9-15(11-4-2-6-13(18)8-11)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m0/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105279
PNG
(CHEMBL3597779)
Show SMILES Brc1cccc(c1)[C@H]1C[C@@H](c2cccc(I)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13BrIN5/c17-12-5-1-3-10(7-12)14-9-15(11-4-2-6-13(18)8-11)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m1/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105275
PNG
(CHEMBL3597697)
Show SMILES Clc1ccccc1[C@@H]1C[C@@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H13BrClN5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m1/s1
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibition of inter...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105306
PNG
(CHEMBL3597782)
Show SMILES Fc1ccc(Br)c(F)c1[C@H]1C[C@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H11Br2F2N5/c17-9-3-1-2-8(6-9)12-7-13(25-16(21-12)22-23-24-25)14-11(19)5-4-10(18)15(14)20/h1-6,12-13H,7H2,(H,21,22,24)/t12-,13+/m0/s1
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n/an/a 3.80E+6n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105310
PNG
(CHEMBL3597786)
Show SMILES Fc1cc(Br)cc(c1)[C@@H]1C[C@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H12Br2FN5/c17-11-3-1-2-9(4-11)15-8-14(20-16-21-22-23-24(15)16)10-5-12(18)7-13(19)6-10/h1-7,14-15H,8H2,(H,20,21,23)/t14-,15+/m0/s1
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n/an/a 1.45E+7n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105272
PNG
(CHEMBL3597694)
Show SMILES Brc1cccc(c1)[C@@H]1C[C@H](c2ccccc2Br)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13Br2N5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m0/s1
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n/an/a 1.89E+7n/an/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-tagged HIF-2alpha PAS-B S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli assessed as inhibi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105259
PNG
(CHEMBL3597685)
Show SMILES Fc1ccc(Br)c(F)c1C1CC(Nc2nnnn12)c1cccc(Br)c1
Show InChI InChI=1S/C16H11Br2F2N5/c17-9-3-1-2-8(6-9)12-7-13(25-16(21-12)22-23-24-25)14-11(19)5-4-10(18)15(14)20/h1-6,12-13H,7H2,(H,21,22,24)
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n/an/an/a 49n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105270
PNG
(CHEMBL3597692)
Show SMILES Ic1cccc(c1)[C@@H]1C[C@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H14IN5/c17-13-8-4-7-12(9-13)14-10-15(11-5-2-1-3-6-11)22-16(18-14)19-20-21-22/h1-9,14-15H,10H2,(H,18,19,21)/t14-,15+/m0/s1
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n/an/an/a 1.24E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105274
PNG
(CHEMBL3597696)
Show SMILES Clc1ccccc1[C@H]1C[C@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H13BrClN5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m0/s1
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n/an/an/a 294n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105275
PNG
(CHEMBL3597697)
Show SMILES Clc1ccccc1[C@@H]1C[C@@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H13BrClN5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m1/s1
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n/an/an/a>2.00E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105318
PNG
(CHEMBL3597672)
Show SMILES Brc1cccc(c1)C1CC(c2ccccc2Br)n2nnnc2N1
Show InChI InChI=1S/C16H13Br2N5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)
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n/an/an/a 400n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105310
PNG
(CHEMBL3597786)
Show SMILES Fc1cc(Br)cc(c1)[C@@H]1C[C@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H12Br2FN5/c17-11-3-1-2-9(4-11)15-8-14(20-16-21-22-23-24(15)16)10-5-12(18)7-13(19)6-10/h1-7,14-15H,8H2,(H,20,21,23)/t14-,15+/m0/s1
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n/an/an/a 2.00E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to His6-Gbeta1-fused HIF-2alpha PAS-B domain S304M mutant (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysi...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105257
PNG
(CHEMBL3597683)
Show SMILES Fc1ccc(Cl)c(F)c1C1CC(Nc2nnnn12)c1cccc(Br)c1
Show InChI InChI=1S/C16H11BrClF2N5/c17-9-3-1-2-8(6-9)12-7-13(25-16(21-12)22-23-24-25)14-11(19)5-4-10(18)15(14)20/h1-6,12-13H,7H2,(H,21,22,24)
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n/an/an/a 85n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105316
PNG
(CHEMBL3597670)
Show SMILES Brc1cccc(c1)C1CC(c2ccccc2I)n2nnnc2N1
Show InChI InChI=1S/C16H13BrIN5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)
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n/an/an/a 766n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105319
PNG
(CHEMBL3597673)
Show SMILES Clc1ccccc1C1CC(Nc2nnnn12)c1cccc(Br)c1
Show InChI InChI=1S/C16H13BrClN5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)
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n/an/an/a 361n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105324
PNG
(CHEMBL3597677)
Show SMILES Brc1cccc(c1)C1CC(c2cccc(I)c2)n2nnnc2N1
Show InChI InChI=1S/C16H13BrIN5/c17-12-5-1-3-10(7-12)14-9-15(11-4-2-6-13(18)8-11)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)
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n/an/an/a 103n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105255
PNG
(CHEMBL3597681)
Show SMILES Fc1ccc(F)c(C2CC(Nc3nnnn23)c2cccc(Br)c2)c1F
Show InChI InChI=1S/C16H11BrF3N5/c17-9-3-1-2-8(6-9)12-7-13(25-16(21-12)22-23-24-25)14-10(18)4-5-11(19)15(14)20/h1-6,12-13H,7H2,(H,21,22,24)
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n/an/an/a 393n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105266
PNG
(CHEMBL3597688)
Show SMILES Fc1cc(Br)cc(c1)C1CC(c2ccccc2)n2nnnc2N1
Show InChI InChI=1S/C16H13BrFN5/c17-12-6-11(7-13(18)8-12)14-9-15(10-4-2-1-3-5-10)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)
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n/an/an/a 216n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105279
PNG
(CHEMBL3597779)
Show SMILES Brc1cccc(c1)[C@H]1C[C@@H](c2cccc(I)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13BrIN5/c17-12-5-1-3-10(7-12)14-9-15(11-4-2-6-13(18)8-11)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m1/s1
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n/an/an/a>2.00E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105308
PNG
(CHEMBL3597784)
Show SMILES Fc1cc(Br)cc(c1)[C@@H]1C[C@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13BrFN5/c17-12-6-11(7-13(18)8-12)14-9-15(10-4-2-1-3-5-10)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m0/s1
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n/an/an/a 165n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105310
PNG
(CHEMBL3597786)
Show SMILES Fc1cc(Br)cc(c1)[C@@H]1C[C@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H12Br2FN5/c17-11-3-1-2-9(4-11)15-8-14(20-16-21-22-23-24(15)16)10-5-12(18)7-13(19)6-10/h1-7,14-15H,8H2,(H,20,21,23)/t14-,15+/m0/s1
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n/an/an/a 23n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105317
PNG
(CHEMBL3597671)
Show SMILES Fc1ccccc1C1CC(Nc2nnnn12)c1cccc(Br)c1
Show InChI InChI=1S/C16H13BrFN5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)
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n/an/an/a 327n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105260
PNG
(CHEMBL3597686)
Show SMILES Fc1c(Br)ccc(Br)c1C1CC(Nc2nnnn12)c1cccc(Br)c1
Show InChI InChI=1S/C16H11Br3FN5/c17-9-3-1-2-8(6-9)12-7-13(25-16(21-12)22-23-24-25)14-10(18)4-5-11(19)15(14)20/h1-6,12-13H,7H2,(H,21,22,24)
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n/an/an/a 240n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105273
PNG
(CHEMBL3597695)
Show SMILES Brc1cccc(c1)[C@H]1C[C@@H](c2ccccc2Br)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13Br2N5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m1/s1
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n/an/an/a>2.00E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105312
PNG
(CHEMBL3597787)
Show SMILES Fc1cc(Br)cc(c1)[C@H]1C[C@@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H12Br2FN5/c17-11-3-1-2-9(4-11)15-8-14(20-16-21-22-23-24(15)16)10-5-12(18)7-13(19)6-10/h1-7,14-15H,8H2,(H,20,21,23)/t14-,15+/m1/s1
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n/an/an/a>2.00E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105254
PNG
(CHEMBL3597680)
Show SMILES Fc1c(Cl)cccc1C1CC(Nc2nnnn12)c1cccc(Br)c1
Show InChI InChI=1S/C16H12BrClFN5/c17-10-4-1-3-9(7-10)13-8-14(24-16(20-13)21-22-23-24)11-5-2-6-12(18)15(11)19/h1-7,13-14H,8H2,(H,20,21,23)
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n/an/an/a 38n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105256
PNG
(CHEMBL3597682)
Show SMILES Fc1ccc(Br)c(Cl)c1C1CC(Nc2nnnn12)c1cccc(Br)c1
Show InChI InChI=1S/C16H11Br2ClFN5/c17-9-3-1-2-8(6-9)12-7-13(25-16(21-12)22-23-24-25)14-11(20)5-4-10(18)15(14)19/h1-6,12-13H,7H2,(H,21,22,24)
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University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105277
PNG
(CHEMBL3597699)
Show SMILES Brc1cccc(c1)[C@H]1C[C@@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13Br2N5/c17-12-5-1-3-10(7-12)14-9-15(11-4-2-6-13(18)8-11)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m1/s1
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n/an/an/a>2.00E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105278
PNG
(CHEMBL3597778)
Show SMILES Brc1cccc(c1)[C@@H]1C[C@H](c2cccc(I)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13BrIN5/c17-12-5-1-3-10(7-12)14-9-15(11-4-2-6-13(18)8-11)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m0/s1
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n/an/an/a 109n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105280
PNG
(CHEMBL3597780)
Show SMILES Clc1ccc(Br)cc1[C@H]1C[C@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H12Br2ClN5/c17-10-3-1-2-9(6-10)14-8-15(24-16(20-14)21-22-23-24)12-7-11(18)4-5-13(12)19/h1-7,14-15H,8H2,(H,20,21,23)/t14-,15+/m0/s1
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n/an/an/a 125n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105307
PNG
(CHEMBL3597783)
Show SMILES Fc1ccc(Br)c(F)c1[C@@H]1C[C@@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H11Br2F2N5/c17-9-3-1-2-8(6-9)12-7-13(25-16(21-12)22-23-24-25)14-11(19)5-4-10(18)15(14)20/h1-6,12-13H,7H2,(H,21,22,24)/t12-,13+/m1/s1
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n/an/an/a>2.00E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105314
PNG
(CHEMBL3597668)
Show SMILES CC(C)CC1CC(Nc2nnnn12)c1cccc(Br)c1
Show InChI InChI=1S/C14H18BrN5/c1-9(2)6-12-8-13(10-4-3-5-11(15)7-10)16-14-17-18-19-20(12)14/h3-5,7,9,12-13H,6,8H2,1-2H3,(H,16,17,19)
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n/an/an/a 1.17E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50105310
PNG
(CHEMBL3597786)
Show SMILES Fc1cc(Br)cc(c1)[C@@H]1C[C@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H12Br2FN5/c17-11-3-1-2-9(4-11)15-8-14(20-16-21-22-23-24(15)16)10-5-12(18)7-13(19)6-10/h1-7,14-15H,8H2,(H,20,21,23)/t14-,15+/m0/s1
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n/an/an/a>5.00E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type GST-fused HIF-1alpha PAS-B domain (238 to 349) (unknown origin) expressed in Escherichia coli assessed as compound-prot...

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105269
PNG
(CHEMBL3597691)
Show SMILES Brc1cccc(c1)[C@H]1C[C@@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H14BrN5/c17-13-8-4-7-12(9-13)14-10-15(11-5-2-1-3-6-11)22-16(18-14)19-20-21-22/h1-9,14-15H,10H2,(H,18,19,21)/t14-,15+/m1/s1
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n/an/an/a>2.00E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105272
PNG
(CHEMBL3597694)
Show SMILES Brc1cccc(c1)[C@@H]1C[C@H](c2ccccc2Br)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13Br2N5/c17-11-5-3-4-10(8-11)14-9-15(12-6-1-2-7-13(12)18)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m0/s1
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n/an/an/a 360n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105304
PNG
(CHEMBL3597781)
Show SMILES Clc1ccc(Br)cc1[C@@H]1C[C@@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H12Br2ClN5/c17-10-3-1-2-9(6-10)14-8-15(24-16(20-14)21-22-23-24)12-7-11(18)4-5-13(12)19/h1-7,14-15H,8H2,(H,20,21,23)/t14-,15+/m1/s1
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n/an/an/a>2.00E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105306
PNG
(CHEMBL3597782)
Show SMILES Fc1ccc(Br)c(F)c1[C@H]1C[C@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Show InChI InChI=1S/C16H11Br2F2N5/c17-9-3-1-2-8(6-9)12-7-13(25-16(21-12)22-23-24-25)14-11(19)5-4-10(18)15(14)20/h1-6,12-13H,7H2,(H,21,22,24)/t12-,13+/m0/s1
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n/an/an/a 34n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105315
PNG
(CHEMBL3597669)
Show SMILES Ic1cccc(c1)C1CC(c2ccccc2)n2nnnc2N1
Show InChI InChI=1S/C16H14IN5/c17-13-8-4-7-12(9-13)14-10-15(11-5-2-1-3-6-11)22-16(18-14)19-20-21-22/h1-9,14-15H,10H2,(H,18,19,21)
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n/an/an/a 1.41E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105326
PNG
(CHEMBL3597679)
Show SMILES Clc1ccc(Br)cc1C1CC(Nc2nnnn12)c1cccc(Br)c1
Show InChI InChI=1S/C16H12Br2ClN5/c17-10-3-1-2-9(6-10)14-8-15(24-16(20-14)21-22-23-24)12-7-11(18)4-5-13(12)19/h1-7,14-15H,8H2,(H,20,21,23)
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n/an/an/a 126n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105258
PNG
(CHEMBL3597684)
Show SMILES Fc1c(Cl)ccc(Cl)c1C1CC(Nc2nnnn12)c1cccc(Br)c1
Show InChI InChI=1S/C16H11BrCl2FN5/c17-9-3-1-2-8(6-9)12-7-13(25-16(21-12)22-23-24-25)14-10(18)4-5-11(19)15(14)20/h1-6,12-13H,7H2,(H,21,22,24)
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n/an/an/a 194n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105271
PNG
(CHEMBL3597693)
Show SMILES Ic1cccc(c1)[C@H]1C[C@@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H14IN5/c17-13-8-4-7-12(9-13)14-10-15(11-5-2-1-3-6-11)22-16(18-14)19-20-21-22/h1-9,14-15H,10H2,(H,18,19,21)/t14-,15+/m1/s1
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n/an/an/a>2.00E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105276
PNG
(CHEMBL3597698)
Show SMILES Brc1cccc(c1)[C@@H]1C[C@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13Br2N5/c17-12-5-1-3-10(7-12)14-9-15(11-4-2-6-13(18)8-11)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m0/s1
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n/an/an/a 63n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105320
PNG
(CHEMBL3597674)
Show SMILES Clc1ccccc1C1CC(Nc2nnnn12)c1cccc(I)c1
Show InChI InChI=1S/C16H13ClIN5/c17-13-7-2-1-6-12(13)15-9-14(10-4-3-5-11(18)8-10)19-16-20-21-22-23(15)16/h1-8,14-15H,9H2,(H,19,20,22)
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n/an/an/a 837n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105325
PNG
(CHEMBL3597678)
Show SMILES Fc1ccc(I)cc1C1CC(Nc2nnnn12)c1cccc(Br)c1
Show InChI InChI=1S/C16H12BrFIN5/c17-10-3-1-2-9(6-10)14-8-15(24-16(20-14)21-22-23-24)12-7-11(19)4-5-13(12)18/h1-7,14-15H,8H2,(H,20,21,23)
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n/an/an/a 159n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105265
PNG
(CHEMBL3597687)
Show SMILES Fc1c(Br)ccc(Cl)c1C1CC(Nc2nnnn12)c1cccc(Br)c1
Show InChI InChI=1S/C16H11Br2ClFN5/c17-9-3-1-2-8(6-9)12-7-13(25-16(21-12)22-23-24-25)14-11(19)5-4-10(18)15(14)20/h1-6,12-13H,7H2,(H,21,22,24)
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n/an/an/a 85n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105267
PNG
(CHEMBL3597689)
Show SMILES Fc1cc(Br)cc(c1)C1CC(c2cccc(Br)c2)n2nnnc2N1
Show InChI InChI=1S/C16H12Br2FN5/c17-11-3-1-2-9(4-11)15-8-14(20-16-21-22-23-24(15)16)10-5-12(18)7-13(19)6-10/h1-7,14-15H,8H2,(H,20,21,23)
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n/an/an/a 28n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105268
PNG
(CHEMBL3597690)
Show SMILES Brc1cccc(c1)[C@@H]1C[C@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H14BrN5/c17-13-8-4-7-12(9-13)14-10-15(11-5-2-1-3-6-11)22-16(18-14)19-20-21-22/h1-9,14-15H,10H2,(H,18,19,21)/t14-,15+/m0/s1
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n/an/an/a 487n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105309
PNG
(CHEMBL3597785)
Show SMILES Fc1cc(Br)cc(c1)[C@H]1C[C@@H](c2ccccc2)n2nnnc2N1 |r|
Show InChI InChI=1S/C16H13BrFN5/c17-12-6-11(7-13(18)8-12)14-9-15(10-4-2-1-3-5-10)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)/t14-,15+/m1/s1
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n/an/an/a>2.00E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM48562
PNG
(5-(3-bromophenyl)-7-phenyl-1,5,6,7-tetrahydro-[1,2...)
Show SMILES Brc1cccc(c1)C1CC(c2ccccc2)n2nnnc2N1
Show InChI InChI=1S/C16H14BrN5/c17-13-8-4-7-12(9-13)14-10-15(11-5-2-1-3-6-11)22-16(18-14)19-20-21-22/h1-9,14-15H,10H2,(H,18,19,21)
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n/an/an/a 883n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105313
PNG
(CHEMBL3597667)
Show SMILES C1C(Nc2nnnn2C1c1ccccc1)c1ccccc1
Show InChI InChI=1S/C16H15N5/c1-3-7-12(8-4-1)14-11-15(13-9-5-2-6-10-13)21-16(17-14)18-19-20-21/h1-10,14-15H,11H2,(H,17,18,20)
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n/an/an/a>2.00E+3n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105322
PNG
(CHEMBL3597675)
Show SMILES Clc1cccc(c1)C1CC(Nc2nnnn12)c1cccc(Br)c1
Show InChI InChI=1S/C16H13BrClN5/c17-12-5-1-3-10(7-12)14-9-15(11-4-2-6-13(18)8-11)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)
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n/an/an/a 116n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM50105323
PNG
(CHEMBL3597676)
Show SMILES Brc1cccc(c1)C1CC(c2cccc(Br)c2)n2nnnc2N1
Show InChI InChI=1S/C16H13Br2N5/c17-12-5-1-3-10(7-12)14-9-15(11-4-2-6-13(18)8-11)23-16(19-14)20-21-22-23/h1-8,14-15H,9H2,(H,19,20,22)
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n/an/an/a 70n/an/an/an/an/a



University of Texas Southwestern Medical Center

Curated by ChEMBL


Assay Description
Binding affinity to wild type His6-Gbeta1-fused HIF-2alpha PAS-B domain (240 to 350) (unknown origin) expressed in Escherichia coli by ITC analysis

J Med Chem 58: 5930-41 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00529
BindingDB Entry DOI: 10.7270/Q2G162K1
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
* indicates data uncertainty>20%