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USPatent US9353081

Compile data set for download or QSAR
Found 132 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
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233818
PNG
(US9353081, 16 | US9353081, 18 | US9353081, 19)
Show SMILES C[C@@H](O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H25N3O3/c1-13(26)22(28)24-19-5-3-4-16-17(11-23-12-18(16)19)14-6-8-20-15(10-14)7-9-21(27)25(20)2/h6,8,10-13,19,26H,3-5,7,9H2,1-2H3,(H,24,28)/t13-,19?/m1/s1
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US Patent
n/an/an/an/a 30.8n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233830
PNG
(US9353081, 31 | US9353081, 32)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C21H24FN3O3S/c1-3-29(27,28)24-19-6-4-5-14-16(11-23-12-17(14)19)15-9-13-7-8-21(26)25(2)20(13)10-18(15)22/h9-12,19,24H,3-8H2,1-2H3
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n/an/an/an/a 78.2n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233832
PNG
(US9353081, 34)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1Cl
Show InChI InChI=1S/C21H24ClN3O3S/c1-3-29(27,28)24-19-6-4-5-14-16(11-23-12-17(14)19)15-9-13-7-8-21(26)25(2)20(13)10-18(15)22/h9-12,19,24H,3-8H2,1-2H3
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n/an/an/an/a 386n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233843
PNG
(US9353081, 47)
Show SMILES CCC(=O)N[C@@H]1[C@@H](C)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C23H27N3O2/c1-4-21(27)25-23-14(2)5-8-17-18(12-24-13-19(17)23)15-6-9-20-16(11-15)7-10-22(28)26(20)3/h6,9,11-14,23H,4-5,7-8,10H2,1-3H3,(H,25,27)/t14-,23+/m0/s1
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n/an/an/an/a 1.82E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233851
PNG
(US9353081, 55)
Show SMILES CCC(=O)N[C@H]1[C@@H](F)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C22H23F2N3O2/c1-3-20(28)26-22-16-11-25-10-15(13(16)5-6-17(22)23)14-8-12-4-7-21(29)27(2)19(12)9-18(14)24/h8-11,17,22H,3-7H2,1-2H3,(H,26,28)/t17-,22+/m0/s1
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n/an/an/an/a 158n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233803
PNG
(US9353081, 1 | US9353081, 2 | US9353081, 3)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C22H25N3O2/c1-3-21(26)24-19-6-4-5-16-17(12-23-13-18(16)19)14-7-9-20-15(11-14)8-10-22(27)25(20)2/h7,9,11-13,19H,3-6,8,10H2,1-2H3,(H,24,26)
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n/an/an/an/a 1.21E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233813
PNG
(US9353081, 11)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2N(CCNC(=O)OC(C)(C)C)CCCc12
Show InChI InChI=1S/C25H32N4O3/c1-25(2,3)32-24(31)27-11-13-29-12-5-6-19-20(15-26-16-22(19)29)17-7-9-21-18(14-17)8-10-23(30)28(21)4/h7,9,14-16H,5-6,8,10-13H2,1-4H3,(H,27,31)
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n/an/an/an/a 420n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233815
PNG
(US9353081, 13)
Show SMILES CCC(=O)NCCN1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C23H28N4O2/c1-3-22(28)25-10-12-27-11-4-5-18-19(14-24-15-21(18)27)16-6-8-20-17(13-16)7-9-23(29)26(20)2/h6,8,13-15H,3-5,7,9-12H2,1-2H3,(H,25,28)
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n/an/an/an/a 1.81E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233817
PNG
(US9353081, 15)
Show SMILES CC(O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C22H25N3O3/c1-13(26)22(28)24-19-5-3-4-16-17(11-23-12-18(16)19)14-6-8-20-15(10-14)7-9-21(27)25(20)2/h6,8,10-13,19,26H,3-5,7,9H2,1-2H3,(H,24,28)
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n/an/an/an/a 574n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233818
PNG
(US9353081, 16 | US9353081, 18 | US9353081, 19)
Show SMILES C[C@@H](O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H25N3O3/c1-13(26)22(28)24-19-5-3-4-16-17(11-23-12-18(16)19)14-6-8-20-15(10-14)7-9-21(27)25(20)2/h6,8,10-13,19,26H,3-5,7,9H2,1-2H3,(H,24,28)/t13-,19?/m1/s1
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n/an/an/an/a 1.05E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233819
PNG
(US9353081, 17 | US9353081, 20 | US9353081, 21)
Show SMILES C[C@H](O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H25N3O3/c1-13(26)22(28)24-19-5-3-4-16-17(11-23-12-18(16)19)14-6-8-20-15(10-14)7-9-21(27)25(20)2/h6,8,10-13,19,26H,3-5,7,9H2,1-2H3,(H,24,28)/t13-,19?/m0/s1
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n/an/an/an/a 598n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233824
PNG
(US9353081, 22 | US9353081, 23 | US9353081, 24)
Show SMILES CCC(=O)NC1CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C21H22FN3O2/c1-3-20(26)24-18-6-5-13-15(10-23-11-16(13)18)14-8-12-4-7-21(27)25(2)19(12)9-17(14)22/h8-11,18H,3-7H2,1-2H3,(H,24,26)
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n/an/an/an/a 466n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233828
PNG
(US9353081, 28 | US9353081, 29 | US9353081, 30)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C22H24FN3O2/c1-3-21(27)25-19-6-4-5-14-16(11-24-12-17(14)19)15-9-13-7-8-22(28)26(2)20(13)10-18(15)23/h9-12,19H,3-8H2,1-2H3,(H,25,27)
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n/an/an/an/a 4.26E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233831
PNG
(US9353081, 33 | US9353081, 40 | US9353081, 41)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C22H24ClN3O2/c1-3-20(27)25-19-6-4-5-15-16(11-24-12-17(15)19)14-9-13-7-8-21(28)26(2)22(13)18(23)10-14/h9-12,19H,3-8H2,1-2H3,(H,25,27)
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n/an/an/an/a 1.16E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233842
PNG
(US9353081, 46)
Show SMILES CCC(=O)N[C@@H]1[C@H](C)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C23H27N3O2/c1-4-21(27)25-23-14(2)5-8-17-18(12-24-13-19(17)23)15-6-9-20-16(11-15)7-10-22(28)26(20)3/h6,9,11-14,23H,4-5,7-8,10H2,1-3H3,(H,25,27)/t14-,23-/m1/s1
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n/an/an/an/a 1.93E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233850
PNG
(US9353081, 54)
Show SMILES CCC(=O)N[C@H]1[C@H](F)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C22H23F2N3O2/c1-3-20(28)26-22-16-11-25-10-15(13(16)5-6-17(22)23)14-8-12-4-7-21(29)27(2)19(12)9-18(14)24/h8-11,17,22H,3-7H2,1-2H3,(H,26,28)/t17-,22-/m1/s1
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n/an/an/an/a 2.39E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233810
PNG
(US9353081, 7 | US9353081, 9)
Show SMILES CCC(=O)NC1CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H23N3O2/c1-3-20(25)23-18-7-6-15-16(11-22-12-17(15)18)13-4-8-19-14(10-13)5-9-21(26)24(19)2/h4,8,10-12,18H,3,5-7,9H2,1-2H3,(H,23,25)
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n/an/an/an/a 13n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233819
PNG
(US9353081, 17 | US9353081, 20 | US9353081, 21)
Show SMILES C[C@H](O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H25N3O3/c1-13(26)22(28)24-19-5-3-4-16-17(11-23-12-18(16)19)14-6-8-20-15(10-14)7-9-21(27)25(20)2/h6,8,10-13,19,26H,3-5,7,9H2,1-2H3,(H,24,28)/t13-,19?/m0/s1
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n/an/an/an/a 28n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233824
PNG
(US9353081, 22 | US9353081, 23 | US9353081, 24)
Show SMILES CCC(=O)NC1CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C21H22FN3O2/c1-3-20(26)24-18-6-5-13-15(10-23-11-16(13)18)14-8-12-4-7-21(27)25(2)19(12)9-17(14)22/h8-11,18H,3-7H2,1-2H3,(H,24,26)
PDB

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n/an/an/an/a 3.80n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233828
PNG
(US9353081, 28 | US9353081, 29 | US9353081, 30)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C22H24FN3O2/c1-3-21(27)25-19-6-4-5-14-16(11-24-12-17(14)19)15-9-13-7-8-22(28)26(2)20(13)10-18(15)23/h9-12,19H,3-8H2,1-2H3,(H,25,27)
PDB

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n/an/an/an/a 1.79E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233828
PNG
(US9353081, 28 | US9353081, 29 | US9353081, 30)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C22H24FN3O2/c1-3-21(27)25-19-6-4-5-14-16(11-24-12-17(14)19)15-9-13-7-8-22(28)26(2)20(13)10-18(15)23/h9-12,19H,3-8H2,1-2H3,(H,25,27)
PDB

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n/an/an/an/a 30n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233830
PNG
(US9353081, 31 | US9353081, 32)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C21H24FN3O3S/c1-3-29(27,28)24-19-6-4-5-14-16(11-23-12-17(14)19)15-9-13-7-8-21(26)25(2)20(13)10-18(15)22/h9-12,19,24H,3-8H2,1-2H3
PDB

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n/an/an/an/a 1.04E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233831
PNG
(US9353081, 33 | US9353081, 40 | US9353081, 41)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C22H24ClN3O2/c1-3-20(27)25-19-6-4-5-15-16(11-24-12-17(15)19)14-9-13-7-8-21(28)26(2)22(13)18(23)10-14/h9-12,19H,3-8H2,1-2H3,(H,25,27)
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n/an/an/an/a 79.8n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233834
PNG
(US9353081, 36)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc(F)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H24FN3O3S/c1-3-29(27,28)24-19-6-4-5-15-16(11-23-12-17(15)19)14-9-13-7-8-20(26)25(2)21(13)18(22)10-14/h9-12,19,24H,3-8H2,1-2H3
PDB

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n/an/an/an/a 239n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233838
PNG
(US9353081, 42)
Show SMILES CCC(=O)N[C@H]1[C@H](C)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C23H27N3O2/c1-4-21(27)25-23-14(2)5-8-17-18(12-24-13-19(17)23)15-6-9-20-16(11-15)7-10-22(28)26(20)3/h6,9,11-14,23H,4-5,7-8,10H2,1-3H3,(H,25,27)/t14-,23+/m1/s1
PDB

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n/an/an/an/a 14.5n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233839
PNG
(US9353081, 43)
Show SMILES CCC(=O)N[C@@H]1[C@H](C)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C23H26FN3O2/c1-4-21(28)26-23-13(2)5-7-15-17(11-25-12-18(15)23)16-9-14-6-8-22(29)27(3)20(14)10-19(16)24/h9-13,23H,4-8H2,1-3H3,(H,26,28)/t13-,23-/m1/s1
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n/an/an/an/a 452n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233849
PNG
(US9353081, 53)
Show SMILES CCC(=O)N[C@H]1[C@@H](F)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H24FN3O2/c1-3-20(27)25-22-17-12-24-11-16(15(17)6-7-18(22)23)13-4-8-19-14(10-13)5-9-21(28)26(19)2/h4,8,10-12,18,22H,3,5-7,9H2,1-2H3,(H,25,27)/t18-,22+/m0/s1
PDB

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n/an/an/an/a 122n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233868
PNG
(US9353081, 62)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@@H](CCCc12)NC(=O)c1ncccc1Cl |r|
Show InChI InChI=1S/C25H23ClN4O2/c1-30-22-9-7-15(12-16(22)8-10-23(30)31)18-13-27-14-19-17(18)4-2-6-21(19)29-25(32)24-20(26)5-3-11-28-24/h3,5,7,9,11-14,21H,2,4,6,8,10H2,1H3,(H,29,32)/t21-/m1/s1
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n/an/an/an/a 5.30n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233856
PNG
(US9353081, 67 | US9353081, 68 | US9353081, 69)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2C(O)CCCc12
Show InChI InChI=1S/C19H20N2O2/c1-21-17-7-5-12(9-13(17)6-8-19(21)23)15-10-20-11-16-14(15)3-2-4-18(16)22/h5,7,9-11,18,22H,2-4,6,8H2,1H3
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n/an/an/an/a 4.70n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233807
PNG
(US9353081, 4 | US9353081, 5 | US9353081, 6)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H25N3O3S/c1-3-28(26,27)23-19-6-4-5-16-17(12-22-13-18(16)19)14-7-9-20-15(11-14)8-10-21(25)24(20)2/h7,9,11-13,19,23H,3-6,8,10H2,1-2H3
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n/an/an/an/a 4.92E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233814
PNG
(US9353081, 12)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2N(CCN)CCCc12
Show InChI InChI=1S/C20H24N4O/c1-23-18-6-4-14(11-15(18)5-7-20(23)25)17-12-22-13-19-16(17)3-2-9-24(19)10-8-21/h4,6,11-13H,2-3,5,7-10,21H2,1H3
PDB

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n/an/an/an/a 1.88E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233816
PNG
(US9353081, 14)
Show SMILES CCS(=O)(=O)NCCN1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C22H28N4O3S/c1-3-30(28,29)24-10-12-26-11-4-5-18-19(14-23-15-21(18)26)16-6-8-20-17(13-16)7-9-22(27)25(20)2/h6,8,13-15,24H,3-5,7,9-12H2,1-2H3
PDB

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n/an/an/an/a 210n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233818
PNG
(US9353081, 16 | US9353081, 18 | US9353081, 19)
Show SMILES C[C@@H](O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H25N3O3/c1-13(26)22(28)24-19-5-3-4-16-17(11-23-12-18(16)19)14-6-8-20-15(10-14)7-9-21(27)25(20)2/h6,8,10-13,19,26H,3-5,7,9H2,1-2H3,(H,24,28)/t13-,19?/m1/s1
PDB

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n/an/an/an/a 1.32E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233826
PNG
(US9353081, 25 | US9353081, 26 | US9353081, 27)
Show SMILES CCS(=O)(=O)NC1CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C20H22FN3O3S/c1-3-28(26,27)23-18-6-5-13-15(10-22-11-16(13)18)14-8-12-4-7-20(25)24(2)19(12)9-17(14)21/h8-11,18,23H,3-7H2,1-2H3
PDB

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n/an/an/an/a 2.98E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233828
PNG
(US9353081, 28 | US9353081, 29 | US9353081, 30)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C22H24FN3O2/c1-3-21(27)25-19-6-4-5-14-16(11-24-12-17(14)19)15-9-13-7-8-22(28)26(2)20(13)10-18(15)23/h9-12,19H,3-8H2,1-2H3,(H,25,27)
PDB

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n/an/an/an/a 3.68E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233835
PNG
(US9353081, 37 | US9353081, 38 | US9353081, 39)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H24ClN3O3S/c1-3-29(27,28)24-19-6-4-5-15-16(11-23-12-17(15)19)14-9-13-7-8-20(26)25(2)21(13)18(22)10-14/h9-12,19,24H,3-8H2,1-2H3
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n/an/an/an/a 1.35E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233848
PNG
(US9353081, 52)
Show SMILES CCC(=O)N[C@H]1[C@H](F)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H24FN3O2/c1-3-20(27)25-22-17-12-24-11-16(15(17)6-7-18(22)23)13-4-8-19-14(10-13)5-9-21(28)26(19)2/h4,8,10-12,18,22H,3,5-7,9H2,1-2H3,(H,25,27)/t18-,22-/m1/s1
PDB

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n/an/an/an/a 1.59E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233872
PNG
(US9353081, 66)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@@H](CCCc12)NS(=O)(=O)C1CC1 |r|
Show InChI InChI=1S/C22H25N3O3S/c1-25-21-9-5-14(11-15(21)6-10-22(25)26)18-12-23-13-19-17(18)3-2-4-20(19)24-29(27,28)16-7-8-16/h5,9,11-13,16,20,24H,2-4,6-8,10H2,1H3/t20-/m1/s1
PDB

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n/an/an/an/a 319n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233856
PNG
(US9353081, 67 | US9353081, 68 | US9353081, 69)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2C(O)CCCc12
Show InChI InChI=1S/C19H20N2O2/c1-21-17-7-5-12(9-13(17)6-8-19(21)23)15-10-20-11-16-14(15)3-2-4-18(16)22/h5,7,9-11,18,22H,2-4,6,8H2,1H3
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n/an/an/an/a 1.62E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233856
PNG
(US9353081, 67 | US9353081, 68 | US9353081, 69)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2C(O)CCCc12
Show InChI InChI=1S/C19H20N2O2/c1-21-17-7-5-12(9-13(17)6-8-19(21)23)15-10-20-11-16-14(15)3-2-4-18(16)22/h5,7,9-11,18,22H,2-4,6,8H2,1H3
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n/an/an/an/a 54.1n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233807
PNG
(US9353081, 4 | US9353081, 5 | US9353081, 6)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H25N3O3S/c1-3-28(26,27)23-19-6-4-5-16-17(12-22-13-18(16)19)14-7-9-20-15(11-14)8-10-21(25)24(20)2/h7,9,11-13,19,23H,3-6,8,10H2,1-2H3
PDB

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n/an/an/an/a 48n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233819
PNG
(US9353081, 17 | US9353081, 20 | US9353081, 21)
Show SMILES C[C@H](O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H25N3O3/c1-13(26)22(28)24-19-5-3-4-16-17(11-23-12-18(16)19)14-6-8-20-15(10-14)7-9-21(27)25(20)2/h6,8,10-13,19,26H,3-5,7,9H2,1-2H3,(H,24,28)/t13-,19?/m0/s1
PDB

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n/an/an/an/a 31.6n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233828
PNG
(US9353081, 28 | US9353081, 29 | US9353081, 30)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C22H24FN3O2/c1-3-21(27)25-19-6-4-5-14-16(11-24-12-17(14)19)15-9-13-7-8-22(28)26(2)20(13)10-18(15)23/h9-12,19H,3-8H2,1-2H3,(H,25,27)
PDB

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n/an/an/an/a 74.9n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233844
PNG
(US9353081, 48)
Show SMILES CCC(=O)N[C@H]1[C@@H](C)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C23H26FN3O2/c1-4-21(28)26-23-13(2)5-7-15-17(11-25-12-18(15)23)16-9-14-6-8-22(29)27(3)20(14)10-19(16)24/h9-13,23H,4-8H2,1-3H3,(H,26,28)/t13-,23-/m0/s1
PDB

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n/an/an/an/a 26.1n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233846
PNG
(US9353081, 50)
Show SMILES CCC(=O)N[C@@H]1[C@@H](F)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H24FN3O2/c1-3-20(27)25-22-17-12-24-11-16(15(17)6-7-18(22)23)13-4-8-19-14(10-13)5-9-21(28)26(19)2/h4,8,10-12,18,22H,3,5-7,9H2,1-2H3,(H,25,27)/t18-,22-/m0/s1
PDB

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n/an/an/an/a 4.32E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233850
PNG
(US9353081, 54)
Show SMILES CCC(=O)N[C@H]1[C@H](F)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C22H23F2N3O2/c1-3-20(28)26-22-16-11-25-10-15(13(16)5-6-17(22)23)14-8-12-4-7-21(29)27(2)19(12)9-18(14)24/h8-11,17,22H,3-7H2,1-2H3,(H,26,28)/t17-,22-/m1/s1
PDB

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n/an/an/an/a 38.8n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233853
PNG
(US9353081, 57)
Show SMILES CCC(=O)N[C@@H]1[C@H](F)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C22H23F2N3O2/c1-3-20(28)26-22-16-11-25-10-15(13(16)5-6-17(22)23)14-8-12-4-7-21(29)27(2)19(12)9-18(14)24/h8-11,17,22H,3-7H2,1-2H3,(H,26,28)/t17-,22+/m1/s1
PDB

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n/an/an/an/a 884n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233854
PNG
(US9353081, 58 | US9353081, 59 | US9353081, 60)
Show SMILES CCC(=O)NC1CCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H22ClN3O2/c1-3-19(26)24-18-6-5-14-15(10-23-11-16(14)18)13-8-12-4-7-20(27)25(2)21(12)17(22)9-13/h8-11,18H,3-7H2,1-2H3,(H,24,26)
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n/an/an/an/a 44.6n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233854
PNG
(US9353081, 58 | US9353081, 59 | US9353081, 60)
Show SMILES CCC(=O)NC1CCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H22ClN3O2/c1-3-19(26)24-18-6-5-14-15(10-23-11-16(14)18)13-8-12-4-7-20(27)25(2)21(12)17(22)9-13/h8-11,18H,3-7H2,1-2H3,(H,24,26)
PDB

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n/an/an/an/a 8.80n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233803
PNG
(US9353081, 1 | US9353081, 2 | US9353081, 3)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C22H25N3O2/c1-3-21(26)24-19-6-4-5-16-17(12-23-13-18(16)19)14-7-9-20-15(11-14)8-10-22(27)25(20)2/h7,9,11-13,19H,3-6,8,10H2,1-2H3,(H,24,26)
PDB

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n/an/an/an/a 980n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233824
PNG
(US9353081, 22 | US9353081, 23 | US9353081, 24)
Show SMILES CCC(=O)NC1CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C21H22FN3O2/c1-3-20(26)24-18-6-5-13-15(10-23-11-16(13)18)14-8-12-4-7-21(27)25(2)19(12)9-17(14)22/h8-11,18H,3-7H2,1-2H3,(H,24,26)
PDB

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n/an/an/an/a 1.20E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233841
PNG
(US9353081, 45)
Show SMILES CCC(=O)N[C@H]1[C@H](C)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C23H26FN3O2/c1-4-21(28)26-23-13(2)5-7-15-17(11-25-12-18(15)23)16-9-14-6-8-22(29)27(3)20(14)10-19(16)24/h9-13,23H,4-8H2,1-3H3,(H,26,28)/t13-,23+/m1/s1
PDB

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n/an/an/an/a 2.62E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233844
PNG
(US9353081, 48)
Show SMILES CCC(=O)N[C@H]1[C@@H](C)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C23H26FN3O2/c1-4-21(28)26-23-13(2)5-7-15-17(11-25-12-18(15)23)16-9-14-6-8-22(29)27(3)20(14)10-19(16)24/h9-13,23H,4-8H2,1-3H3,(H,26,28)/t13-,23-/m0/s1
PDB

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n/an/an/an/a 2.88E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233845
PNG
(US9353081, 49)
Show SMILES CCC(=O)N[C@H]1[C@@H](C)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C23H27N3O2/c1-4-21(27)25-23-14(2)5-8-17-18(12-24-13-19(17)23)15-6-9-20-16(11-15)7-10-22(28)26(20)3/h6,9,11-14,23H,4-5,7-8,10H2,1-3H3,(H,25,27)/t14-,23-/m0/s1
PDB

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n/an/an/an/a 3.95E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233847
PNG
(US9353081, 51)
Show SMILES CCC(=O)N[C@@H]1[C@H](F)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H24FN3O2/c1-3-20(27)25-22-17-12-24-11-16(15(17)6-7-18(22)23)13-4-8-19-14(10-13)5-9-21(28)26(19)2/h4,8,10-12,18,22H,3,5-7,9H2,1-2H3,(H,25,27)/t18-,22+/m1/s1
PDB

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n/an/an/an/a 3.23E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233854
PNG
(US9353081, 58 | US9353081, 59 | US9353081, 60)
Show SMILES CCC(=O)NC1CCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H22ClN3O2/c1-3-19(26)24-18-6-5-14-15(10-23-11-16(14)18)13-8-12-4-7-20(27)25(2)21(12)17(22)9-13/h8-11,18H,3-7H2,1-2H3,(H,24,26)
PDB

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n/an/an/an/a 1.17E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233868
PNG
(US9353081, 62)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@@H](CCCc12)NC(=O)c1ncccc1Cl |r|
Show InChI InChI=1S/C25H23ClN4O2/c1-30-22-9-7-15(12-16(22)8-10-23(30)31)18-13-27-14-19-17(18)4-2-6-21(19)29-25(32)24-20(26)5-3-11-28-24/h3,5,7,9,11-14,21H,2,4,6,8,10H2,1H3,(H,29,32)/t21-/m1/s1
PDB

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n/an/an/an/a 559n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233803
PNG
(US9353081, 1 | US9353081, 2 | US9353081, 3)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C22H25N3O2/c1-3-21(26)24-19-6-4-5-16-17(12-23-13-18(16)19)14-7-9-20-15(11-14)8-10-22(27)25(20)2/h7,9,11-13,19H,3-6,8,10H2,1-2H3,(H,24,26)
PDB

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n/an/an/an/a 30n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233813
PNG
(US9353081, 11)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2N(CCNC(=O)OC(C)(C)C)CCCc12
Show InChI InChI=1S/C25H32N4O3/c1-25(2,3)32-24(31)27-11-13-29-12-5-6-19-20(15-26-16-22(19)29)17-7-9-21-18(14-17)8-10-23(30)28(21)4/h7,9,14-16H,5-6,8,10-13H2,1-4H3,(H,27,31)
PDB

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n/an/an/an/a 23n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233819
PNG
(US9353081, 17 | US9353081, 20 | US9353081, 21)
Show SMILES C[C@H](O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H25N3O3/c1-13(26)22(28)24-19-5-3-4-16-17(11-23-12-18(16)19)14-6-8-20-15(10-14)7-9-21(27)25(20)2/h6,8,10-13,19,26H,3-5,7,9H2,1-2H3,(H,24,28)/t13-,19?/m0/s1
PDB

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US Patent
n/an/an/an/a 823n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233831
PNG
(US9353081, 33 | US9353081, 40 | US9353081, 41)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C22H24ClN3O2/c1-3-20(27)25-19-6-4-5-15-16(11-24-12-17(15)19)14-9-13-7-8-21(28)26(2)22(13)18(23)10-14/h9-12,19H,3-8H2,1-2H3,(H,25,27)
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n/an/an/an/a 126n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233831
PNG
(US9353081, 33 | US9353081, 40 | US9353081, 41)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C22H24ClN3O2/c1-3-20(27)25-19-6-4-5-15-16(11-24-12-17(15)19)14-9-13-7-8-21(28)26(2)22(13)18(23)10-14/h9-12,19H,3-8H2,1-2H3,(H,25,27)
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n/an/an/an/a 16.6n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233845
PNG
(US9353081, 49)
Show SMILES CCC(=O)N[C@H]1[C@@H](C)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C23H27N3O2/c1-4-21(27)25-23-14(2)5-8-17-18(12-24-13-19(17)23)15-6-9-20-16(11-15)7-10-22(28)26(20)3/h6,9,11-14,23H,4-5,7-8,10H2,1-3H3,(H,25,27)/t14-,23-/m0/s1
PDB

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n/an/an/an/a 44.2n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233870
PNG
(US9353081, 64)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@@H](CCCc12)NC(=O)C1CC1 |r|
Show InChI InChI=1S/C23H25N3O2/c1-26-21-9-7-15(11-16(21)8-10-22(26)27)18-12-24-13-19-17(18)3-2-4-20(19)25-23(28)14-5-6-14/h7,9,11-14,20H,2-6,8,10H2,1H3,(H,25,28)/t20-/m1/s1
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n/an/an/an/a 46.2n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233871
PNG
(US9353081, 65)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@@H](CCCc12)NS(C)(=O)=O |r|
Show InChI InChI=1S/C20H23N3O3S/c1-23-19-8-6-13(10-14(19)7-9-20(23)24)16-11-21-12-17-15(16)4-3-5-18(17)22-27(2,25)26/h6,8,10-12,18,22H,3-5,7,9H2,1-2H3/t18-/m1/s1
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n/an/an/an/a 17n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233806
PNG
(US9353081, 3-1)
Show SMILES CCC(=O)N[C@@H]1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H25N3O2/c1-3-21(26)24-19-6-4-5-16-17(12-23-13-18(16)19)14-7-9-20-15(11-14)8-10-22(27)25(20)2/h7,9,11-13,19H,3-6,8,10H2,1-2H3,(H,24,26)/t19-/m1/s1
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n/an/an/an/a 980n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233812
PNG
(US9353081, 10)
Show SMILES CCS(=O)(=O)NC1CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C20H23N3O3S/c1-3-27(25,26)22-18-7-6-15-16(11-21-12-17(15)18)13-4-8-19-14(10-13)5-9-20(24)23(19)2/h4,8,10-12,18,22H,3,5-7,9H2,1-2H3
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n/an/an/an/a 4.17E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233819
PNG
(US9353081, 17 | US9353081, 20 | US9353081, 21)
Show SMILES C[C@H](O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H25N3O3/c1-13(26)22(28)24-19-5-3-4-16-17(11-23-12-18(16)19)14-6-8-20-15(10-14)7-9-21(27)25(20)2/h6,8,10-13,19,26H,3-5,7,9H2,1-2H3,(H,24,28)/t13-,19?/m0/s1
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n/an/an/an/a 2.55E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233828
PNG
(US9353081, 28 | US9353081, 29 | US9353081, 30)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C22H24FN3O2/c1-3-21(27)25-19-6-4-5-14-16(11-24-12-17(14)19)15-9-13-7-8-22(28)26(2)20(13)10-18(15)23/h9-12,19H,3-8H2,1-2H3,(H,25,27)
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n/an/an/an/a 6.82E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233834
PNG
(US9353081, 36)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc(F)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H24FN3O3S/c1-3-29(27,28)24-19-6-4-5-15-16(11-23-12-17(15)19)14-9-13-7-8-20(26)25(2)21(13)18(22)10-14/h9-12,19,24H,3-8H2,1-2H3
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n/an/an/an/a 2.07E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233831
PNG
(US9353081, 33 | US9353081, 40 | US9353081, 41)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C22H24ClN3O2/c1-3-20(27)25-19-6-4-5-15-16(11-24-12-17(15)19)14-9-13-7-8-21(28)26(2)22(13)18(23)10-14/h9-12,19H,3-8H2,1-2H3,(H,25,27)
PDB

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n/an/an/an/a 3.53E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233839
PNG
(US9353081, 43)
Show SMILES CCC(=O)N[C@@H]1[C@H](C)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C23H26FN3O2/c1-4-21(28)26-23-13(2)5-7-15-17(11-25-12-18(15)23)16-9-14-6-8-22(29)27(3)20(14)10-19(16)24/h9-13,23H,4-8H2,1-3H3,(H,26,28)/t13-,23-/m1/s1
PDB

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n/an/an/an/a 3.20E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233852
PNG
(US9353081, 56)
Show SMILES CCC(=O)N[C@@H]1[C@@H](F)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C22H23F2N3O2/c1-3-20(28)26-22-16-11-25-10-15(13(16)5-6-17(22)23)14-8-12-4-7-21(29)27(2)19(12)9-18(14)24/h8-11,17,22H,3-7H2,1-2H3,(H,26,28)/t17-,22-/m0/s1
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n/an/an/an/a 1.49E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233854
PNG
(US9353081, 58 | US9353081, 59 | US9353081, 60)
Show SMILES CCC(=O)NC1CCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H22ClN3O2/c1-3-19(26)24-18-6-5-14-15(10-23-11-16(14)18)13-8-12-4-7-20(27)25(2)21(12)17(22)9-13/h8-11,18H,3-7H2,1-2H3,(H,24,26)
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n/an/an/an/a 7.60E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233807
PNG
(US9353081, 4 | US9353081, 5 | US9353081, 6)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H25N3O3S/c1-3-28(26,27)23-19-6-4-5-16-17(12-22-13-18(16)19)14-7-9-20-15(11-14)8-10-21(25)24(20)2/h7,9,11-13,19,23H,3-6,8,10H2,1-2H3
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n/an/an/an/a 97n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233807
PNG
(US9353081, 4 | US9353081, 5 | US9353081, 6)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H25N3O3S/c1-3-28(26,27)23-19-6-4-5-16-17(12-22-13-18(16)19)14-7-9-20-15(11-14)8-10-21(25)24(20)2/h7,9,11-13,19,23H,3-6,8,10H2,1-2H3
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n/an/an/an/a 1.29E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233818
PNG
(US9353081, 16 | US9353081, 18 | US9353081, 19)
Show SMILES C[C@@H](O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H25N3O3/c1-13(26)22(28)24-19-5-3-4-16-17(11-23-12-18(16)19)14-6-8-20-15(10-14)7-9-21(27)25(20)2/h6,8,10-13,19,26H,3-5,7,9H2,1-2H3,(H,24,28)/t13-,19?/m1/s1
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n/an/an/an/a 493n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233824
PNG
(US9353081, 22 | US9353081, 23 | US9353081, 24)
Show SMILES CCC(=O)NC1CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C21H22FN3O2/c1-3-20(26)24-18-6-5-13-15(10-23-11-16(13)18)14-8-12-4-7-21(27)25(2)19(12)9-17(14)22/h8-11,18H,3-7H2,1-2H3,(H,24,26)
PDB

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n/an/an/an/a 1.38E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233847
PNG
(US9353081, 51)
Show SMILES CCC(=O)N[C@@H]1[C@H](F)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H24FN3O2/c1-3-20(27)25-22-17-12-24-11-16(15(17)6-7-18(22)23)13-4-8-19-14(10-13)5-9-21(28)26(19)2/h4,8,10-12,18,22H,3,5-7,9H2,1-2H3,(H,25,27)/t18-,22+/m1/s1
PDB

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n/an/an/an/a 1.47E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233852
PNG
(US9353081, 56)
Show SMILES CCC(=O)N[C@@H]1[C@@H](F)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C22H23F2N3O2/c1-3-20(28)26-22-16-11-25-10-15(13(16)5-6-17(22)23)14-8-12-4-7-21(29)27(2)19(12)9-18(14)24/h8-11,17,22H,3-7H2,1-2H3,(H,26,28)/t17-,22-/m0/s1
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n/an/an/an/a 2.78E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233854
PNG
(US9353081, 58 | US9353081, 59 | US9353081, 60)
Show SMILES CCC(=O)NC1CCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H22ClN3O2/c1-3-19(26)24-18-6-5-14-15(10-23-11-16(14)18)13-8-12-4-7-20(27)25(2)21(12)17(22)9-13/h8-11,18H,3-7H2,1-2H3,(H,24,26)
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US Patent
n/an/an/an/a 3.29E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233856
PNG
(US9353081, 67 | US9353081, 68 | US9353081, 69)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2C(O)CCCc12
Show InChI InChI=1S/C19H20N2O2/c1-21-17-7-5-12(9-13(17)6-8-19(21)23)15-10-20-11-16-14(15)3-2-4-18(16)22/h5,7,9-11,18,22H,2-4,6,8H2,1H3
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n/an/an/an/a 77.4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233803
PNG
(US9353081, 1 | US9353081, 2 | US9353081, 3)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C22H25N3O2/c1-3-21(26)24-19-6-4-5-16-17(12-23-13-18(16)19)14-7-9-20-15(11-14)8-10-22(27)25(20)2/h7,9,11-13,19H,3-6,8,10H2,1-2H3,(H,24,26)
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US Patent
n/an/an/an/a 2.37E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233807
PNG
(US9353081, 4 | US9353081, 5 | US9353081, 6)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H25N3O3S/c1-3-28(26,27)23-19-6-4-5-16-17(12-22-13-18(16)19)14-7-9-20-15(11-14)8-10-21(25)24(20)2/h7,9,11-13,19,23H,3-6,8,10H2,1-2H3
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n/an/an/an/a 1.19E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233818
PNG
(US9353081, 16 | US9353081, 18 | US9353081, 19)
Show SMILES C[C@@H](O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H25N3O3/c1-13(26)22(28)24-19-5-3-4-16-17(11-23-12-18(16)19)14-6-8-20-15(10-14)7-9-21(27)25(20)2/h6,8,10-13,19,26H,3-5,7,9H2,1-2H3,(H,24,28)/t13-,19?/m1/s1
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US Patent
n/an/an/an/a 1.49E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233826
PNG
(US9353081, 25 | US9353081, 26 | US9353081, 27)
Show SMILES CCS(=O)(=O)NC1CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C20H22FN3O3S/c1-3-28(26,27)23-18-6-5-13-15(10-22-11-16(13)18)14-8-12-4-7-20(25)24(2)19(12)9-17(14)21/h8-11,18,23H,3-7H2,1-2H3
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n/an/an/an/a 1.89E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233835
PNG
(US9353081, 37 | US9353081, 38 | US9353081, 39)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H24ClN3O3S/c1-3-29(27,28)24-19-6-4-5-15-16(11-23-12-17(15)19)14-9-13-7-8-20(26)25(2)21(13)18(22)10-14/h9-12,19,24H,3-8H2,1-2H3
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n/an/an/an/a 1.59E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233871
PNG
(US9353081, 65)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@@H](CCCc12)NS(C)(=O)=O |r|
Show InChI InChI=1S/C20H23N3O3S/c1-23-19-8-6-13(10-14(19)7-9-20(23)24)16-11-21-12-17-15(16)4-3-5-18(17)22-27(2,25)26/h6,8,10-12,18,22H,3-5,7,9H2,1-2H3/t18-/m1/s1
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n/an/an/an/a 1.93E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233856
PNG
(US9353081, 67 | US9353081, 68 | US9353081, 69)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2C(O)CCCc12
Show InChI InChI=1S/C19H20N2O2/c1-21-17-7-5-12(9-13(17)6-8-19(21)23)15-10-20-11-16-14(15)3-2-4-18(16)22/h5,7,9-11,18,22H,2-4,6,8H2,1H3
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n/an/an/an/a 206n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233803
PNG
(US9353081, 1 | US9353081, 2 | US9353081, 3)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C22H25N3O2/c1-3-21(26)24-19-6-4-5-16-17(12-23-13-18(16)19)14-7-9-20-15(11-14)8-10-22(27)25(20)2/h7,9,11-13,19H,3-6,8,10H2,1-2H3,(H,24,26)
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n/an/an/an/a 1.02E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233803
PNG
(US9353081, 1 | US9353081, 2 | US9353081, 3)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C22H25N3O2/c1-3-21(26)24-19-6-4-5-16-17(12-23-13-18(16)19)14-7-9-20-15(11-14)8-10-22(27)25(20)2/h7,9,11-13,19H,3-6,8,10H2,1-2H3,(H,24,26)
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n/an/an/an/a 14n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233806
PNG
(US9353081, 3-1)
Show SMILES CCC(=O)N[C@@H]1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H25N3O2/c1-3-21(26)24-19-6-4-5-16-17(12-23-13-18(16)19)14-7-9-20-15(11-14)8-10-22(27)25(20)2/h7,9,11-13,19H,3-6,8,10H2,1-2H3,(H,24,26)/t19-/m1/s1
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n/an/an/an/a 14n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233812
PNG
(US9353081, 10)
Show SMILES CCS(=O)(=O)NC1CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C20H23N3O3S/c1-3-27(25,26)22-18-7-6-15-16(11-21-12-17(15)18)13-4-8-19-14(10-13)5-9-20(24)23(19)2/h4,8,10-12,18,22H,3,5-7,9H2,1-2H3
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n/an/an/an/a 59n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233816
PNG
(US9353081, 14)
Show SMILES CCS(=O)(=O)NCCN1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C22H28N4O3S/c1-3-30(28,29)24-10-12-26-11-4-5-18-19(14-23-15-21(18)26)16-6-8-20-17(13-16)7-9-22(27)25(20)2/h6,8,13-15,24H,3-5,7,9-12H2,1-2H3
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n/an/an/an/a 11n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233835
PNG
(US9353081, 37 | US9353081, 38 | US9353081, 39)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H24ClN3O3S/c1-3-29(27,28)24-19-6-4-5-15-16(11-23-12-17(15)19)14-9-13-7-8-20(26)25(2)21(13)18(22)10-14/h9-12,19,24H,3-8H2,1-2H3
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n/an/an/an/a 199n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233840
PNG
(US9353081, 44)
Show SMILES CCC(=O)N[C@@H]1[C@@H](C)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C23H26FN3O2/c1-4-21(28)26-23-13(2)5-7-15-17(11-25-12-18(15)23)16-9-14-6-8-22(29)27(3)20(14)10-19(16)24/h9-13,23H,4-8H2,1-3H3,(H,26,28)/t13-,23+/m0/s1
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n/an/an/an/a 529n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233869
PNG
(US9353081, 63)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@@H](CCCc12)NC(C)=O |r|
Show InChI InChI=1S/C21H23N3O2/c1-13(25)23-19-5-3-4-16-17(11-22-12-18(16)19)14-6-8-20-15(10-14)7-9-21(26)24(20)2/h6,8,10-12,19H,3-5,7,9H2,1-2H3,(H,23,25)/t19-/m1/s1
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n/an/an/an/a 4.80n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233810
PNG
(US9353081, 7 | US9353081, 9)
Show SMILES CCC(=O)NC1CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H23N3O2/c1-3-20(25)23-18-7-6-15-16(11-22-12-17(15)18)13-4-8-19-14(10-13)5-9-21(26)24(19)2/h4,8,10-12,18H,3,5-7,9H2,1-2H3,(H,23,25)
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n/an/an/an/a 1.11E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233853
PNG
(US9353081, 57)
Show SMILES CCC(=O)N[C@@H]1[C@H](F)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C22H23F2N3O2/c1-3-20(28)26-22-16-11-25-10-15(13(16)5-6-17(22)23)14-8-12-4-7-21(29)27(2)19(12)9-18(14)24/h8-11,17,22H,3-7H2,1-2H3,(H,26,28)/t17-,22+/m1/s1
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n/an/an/an/a 2.03E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233869
PNG
(US9353081, 63)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@@H](CCCc12)NC(C)=O |r|
Show InChI InChI=1S/C21H23N3O2/c1-13(25)23-19-5-3-4-16-17(11-22-12-18(16)19)14-6-8-20-15(10-14)7-9-21(26)24(20)2/h6,8,10-12,19H,3-5,7,9H2,1-2H3,(H,23,25)/t19-/m1/s1
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n/an/an/an/a 1.19E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233810
PNG
(US9353081, 7 | US9353081, 9)
Show SMILES CCC(=O)NC1CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H23N3O2/c1-3-20(25)23-18-7-6-15-16(11-22-12-17(15)18)13-4-8-19-14(10-13)5-9-21(26)24(19)2/h4,8,10-12,18H,3,5-7,9H2,1-2H3,(H,23,25)
PDB

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n/an/an/an/a 12n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233815
PNG
(US9353081, 13)
Show SMILES CCC(=O)NCCN1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C23H28N4O2/c1-3-22(28)25-10-12-27-11-4-5-18-19(14-24-15-21(18)27)16-6-8-20-17(13-16)7-9-23(29)26(20)2/h6,8,13-15H,3-5,7,9-12H2,1-2H3,(H,25,28)
PDB

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n/an/an/an/a 14n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233826
PNG
(US9353081, 25 | US9353081, 26 | US9353081, 27)
Show SMILES CCS(=O)(=O)NC1CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C20H22FN3O3S/c1-3-28(26,27)23-18-6-5-13-15(10-22-11-16(13)18)14-8-12-4-7-20(25)24(2)19(12)9-17(14)21/h8-11,18,23H,3-7H2,1-2H3
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n/an/an/an/a 11.2n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233835
PNG
(US9353081, 37 | US9353081, 38 | US9353081, 39)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H24ClN3O3S/c1-3-29(27,28)24-19-6-4-5-15-16(11-23-12-17(15)19)14-9-13-7-8-20(26)25(2)21(13)18(22)10-14/h9-12,19,24H,3-8H2,1-2H3
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n/an/an/an/a 422n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233842
PNG
(US9353081, 46)
Show SMILES CCC(=O)N[C@@H]1[C@H](C)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C23H27N3O2/c1-4-21(27)25-23-14(2)5-8-17-18(12-24-13-19(17)23)15-6-9-20-16(11-15)7-10-22(28)26(20)3/h6,9,11-14,23H,4-5,7-8,10H2,1-3H3,(H,25,27)/t14-,23-/m1/s1
PDB

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n/an/an/an/a 467n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233848
PNG
(US9353081, 52)
Show SMILES CCC(=O)N[C@H]1[C@H](F)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H24FN3O2/c1-3-20(27)25-22-17-12-24-11-16(15(17)6-7-18(22)23)13-4-8-19-14(10-13)5-9-21(28)26(19)2/h4,8,10-12,18,22H,3,5-7,9H2,1-2H3,(H,25,27)/t18-,22-/m1/s1
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n/an/an/an/a 25.8n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233867
PNG
(US9353081, 61)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@H](N)CCCc12 |r|
Show InChI InChI=1S/C19H21N3O/c1-22-18-7-5-12(9-13(18)6-8-19(22)23)15-10-21-11-16-14(15)3-2-4-17(16)20/h5,7,9-11,17H,2-4,6,8,20H2,1H3/t17-/m1/s1
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n/an/an/an/a 5.60n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233872
PNG
(US9353081, 66)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@@H](CCCc12)NS(=O)(=O)C1CC1 |r|
Show InChI InChI=1S/C22H25N3O3S/c1-25-21-9-5-14(11-15(21)6-10-22(25)26)18-12-23-13-19-17(18)3-2-4-20(19)24-29(27,28)16-7-8-16/h5,9,11-13,16,20,24H,2-4,6-8,10H2,1H3/t20-/m1/s1
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n/an/an/an/a 35.5n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233856
PNG
(US9353081, 67 | US9353081, 68 | US9353081, 69)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2C(O)CCCc12
Show InChI InChI=1S/C19H20N2O2/c1-21-17-7-5-12(9-13(17)6-8-19(21)23)15-10-20-11-16-14(15)3-2-4-18(16)22/h5,7,9-11,18,22H,2-4,6,8H2,1H3
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n/an/an/an/a 2n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233858
PNG
(US9353081, 70)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2C(=O)CCCc12
Show InChI InChI=1S/C19H18N2O2/c1-21-17-7-5-12(9-13(17)6-8-19(21)23)15-10-20-11-16-14(15)3-2-4-18(16)22/h5,7,9-11H,2-4,6,8H2,1H3
PDB

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n/an/an/an/a 15.7n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233810
PNG
(US9353081, 7 | US9353081, 9)
Show SMILES CCC(=O)NC1CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H23N3O2/c1-3-20(25)23-18-7-6-15-16(11-22-12-17(15)18)13-4-8-19-14(10-13)5-9-21(26)24(19)2/h4,8,10-12,18H,3,5-7,9H2,1-2H3,(H,23,25)
PDB

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n/an/an/an/a 570n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233830
PNG
(US9353081, 31 | US9353081, 32)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C21H24FN3O3S/c1-3-29(27,28)24-19-6-4-5-14-16(11-23-12-17(14)19)15-9-13-7-8-21(26)25(2)20(13)10-18(15)22/h9-12,19,24H,3-8H2,1-2H3
PDB

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n/an/an/an/a 1.45E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233838
PNG
(US9353081, 42)
Show SMILES CCC(=O)N[C@H]1[C@H](C)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C23H27N3O2/c1-4-21(27)25-23-14(2)5-8-17-18(12-24-13-19(17)23)15-6-9-20-16(11-15)7-10-22(28)26(20)3/h6,9,11-14,23H,4-5,7-8,10H2,1-3H3,(H,25,27)/t14-,23+/m1/s1
PDB

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n/an/an/an/a 524n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233867
PNG
(US9353081, 61)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@H](N)CCCc12 |r|
Show InChI InChI=1S/C19H21N3O/c1-22-18-7-5-12(9-13(18)6-8-19(22)23)15-10-21-11-16-14(15)3-2-4-17(16)20/h5,7,9-11,17H,2-4,6,8,20H2,1H3/t17-/m1/s1
PDB

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n/an/an/an/a 450n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233858
PNG
(US9353081, 70)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2C(=O)CCCc12
Show InChI InChI=1S/C19H18N2O2/c1-21-17-7-5-12(9-13(17)6-8-19(21)23)15-10-20-11-16-14(15)3-2-4-18(16)22/h5,7,9-11H,2-4,6,8H2,1H3
PDB

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n/an/an/an/a 7.17E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233814
PNG
(US9353081, 12)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2N(CCN)CCCc12
Show InChI InChI=1S/C20H24N4O/c1-23-18-6-4-14(11-15(18)5-7-20(23)25)17-12-22-13-19-16(17)3-2-9-24(19)10-8-21/h4,6,11-13H,2-3,5,7-10,21H2,1H3
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n/an/an/an/a 4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233817
PNG
(US9353081, 15)
Show SMILES CC(O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C22H25N3O3/c1-13(26)22(28)24-19-5-3-4-16-17(11-23-12-18(16)19)14-6-8-20-15(10-14)7-9-21(27)25(20)2/h6,8,10-13,19,26H,3-5,7,9H2,1-2H3,(H,24,28)
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n/an/an/an/a 77.3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233818
PNG
(US9353081, 16 | US9353081, 18 | US9353081, 19)
Show SMILES C[C@@H](O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H25N3O3/c1-13(26)22(28)24-19-5-3-4-16-17(11-23-12-18(16)19)14-6-8-20-15(10-14)7-9-21(27)25(20)2/h6,8,10-13,19,26H,3-5,7,9H2,1-2H3,(H,24,28)/t13-,19?/m1/s1
PDB

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n/an/an/an/a 27.9n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233824
PNG
(US9353081, 22 | US9353081, 23 | US9353081, 24)
Show SMILES CCC(=O)NC1CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C21H22FN3O2/c1-3-20(26)24-18-6-5-13-15(10-23-11-16(13)18)14-8-12-4-7-21(27)25(2)19(12)9-17(14)22/h8-11,18H,3-7H2,1-2H3,(H,24,26)
PDB

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n/an/an/an/a 10.2n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233826
PNG
(US9353081, 25 | US9353081, 26 | US9353081, 27)
Show SMILES CCS(=O)(=O)NC1CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C20H22FN3O3S/c1-3-28(26,27)23-18-6-5-13-15(10-22-11-16(13)18)14-8-12-4-7-20(25)24(2)19(12)9-17(14)21/h8-11,18,23H,3-7H2,1-2H3
PDB

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n/an/an/an/a 33.4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233826
PNG
(US9353081, 25 | US9353081, 26 | US9353081, 27)
Show SMILES CCS(=O)(=O)NC1CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C20H22FN3O3S/c1-3-28(26,27)23-18-6-5-13-15(10-22-11-16(13)18)14-8-12-4-7-20(25)24(2)19(12)9-17(14)21/h8-11,18,23H,3-7H2,1-2H3
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n/an/an/an/a 4.55E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233833
PNG
(US9353081, 35)
Show SMILES CCC(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1Cl
Show InChI InChI=1S/C22H24ClN3O2/c1-3-21(27)25-19-6-4-5-14-16(11-24-12-17(14)19)15-9-13-7-8-22(28)26(2)20(13)10-18(15)23/h9-12,19H,3-8H2,1-2H3,(H,25,27)
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US Patent
n/an/an/an/a 1.77E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233835
PNG
(US9353081, 37 | US9353081, 38 | US9353081, 39)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H24ClN3O3S/c1-3-29(27,28)24-19-6-4-5-15-16(11-23-12-17(15)19)14-9-13-7-8-20(26)25(2)21(13)18(22)10-14/h9-12,19,24H,3-8H2,1-2H3
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n/an/an/an/a 130n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))		BDBM233841
PNG
(US9353081, 45)
Show SMILES CCC(=O)N[C@H]1[C@H](C)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C23H26FN3O2/c1-4-21(28)26-23-13(2)5-7-15-17(11-25-12-18(15)23)16-9-14-6-8-22(29)27(3)20(14)10-19(16)24/h9-13,23H,4-8H2,1-3H3,(H,26,28)/t13-,23+/m1/s1
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US Patent
n/an/an/an/a 54.9n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233807
PNG
(US9353081, 4 | US9353081, 5 | US9353081, 6)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
Show InChI InChI=1S/C21H25N3O3S/c1-3-28(26,27)23-19-6-4-5-16-17(12-22-13-18(16)19)14-7-9-20-15(11-14)8-10-21(25)24(20)2/h7,9,11-13,19,23H,3-6,8,10H2,1-2H3
PDB

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n/an/an/an/a 1.75E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233819
PNG
(US9353081, 17 | US9353081, 20 | US9353081, 21)
Show SMILES C[C@H](O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H25N3O3/c1-13(26)22(28)24-19-5-3-4-16-17(11-23-12-18(16)19)14-6-8-20-15(10-14)7-9-21(27)25(20)2/h6,8,10-13,19,26H,3-5,7,9H2,1-2H3,(H,24,28)/t13-,19?/m0/s1
PDB

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n/an/an/an/a 885n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233830
PNG
(US9353081, 31 | US9353081, 32)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
Show InChI InChI=1S/C21H24FN3O3S/c1-3-29(27,28)24-19-6-4-5-14-16(11-23-12-17(14)19)15-9-13-7-8-21(26)25(2)20(13)10-18(15)22/h9-12,19,24H,3-8H2,1-2H3
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n/an/an/an/a 4.24E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233832
PNG
(US9353081, 34)
Show SMILES CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1Cl
Show InChI InChI=1S/C21H24ClN3O3S/c1-3-29(27,28)24-19-6-4-5-14-16(11-23-12-17(14)19)15-9-13-7-8-21(26)25(2)20(13)10-18(15)22/h9-12,19,24H,3-8H2,1-2H3
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US Patent
n/an/an/an/a 3.47E+4n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233840
PNG
(US9353081, 44)
Show SMILES CCC(=O)N[C@@H]1[C@@H](C)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C23H26FN3O2/c1-4-21(28)26-23-13(2)5-7-15-17(11-25-12-18(15)23)16-9-14-6-8-22(29)27(3)20(14)10-19(16)24/h9-13,23H,4-8H2,1-3H3,(H,26,28)/t13-,23+/m0/s1
PDB

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n/an/an/an/a 2.05E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233849
PNG
(US9353081, 53)
Show SMILES CCC(=O)N[C@H]1[C@@H](F)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
Show InChI InChI=1S/C22H24FN3O2/c1-3-20(27)25-22-17-12-24-11-16(15(17)6-7-18(22)23)13-4-8-19-14(10-13)5-9-21(28)26(19)2/h4,8,10-12,18,22H,3,5-7,9H2,1-2H3,(H,25,27)/t18-,22+/m0/s1
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n/an/an/an/a 3.57E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233851
PNG
(US9353081, 55)
Show SMILES CCC(=O)N[C@H]1[C@@H](F)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
Show InChI InChI=1S/C22H23F2N3O2/c1-3-20(28)26-22-16-11-25-10-15(13(16)5-6-17(22)23)14-8-12-4-7-21(29)27(2)19(12)9-18(14)24/h8-11,17,22H,3-7H2,1-2H3,(H,26,28)/t17-,22+/m0/s1
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n/an/an/an/a 2.76E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))		BDBM233870
PNG
(US9353081, 64)
Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@@H](CCCc12)NC(=O)C1CC1 |r|
Show InChI InChI=1S/C23H25N3O2/c1-26-21-9-7-15(11-16(21)8-10-22(26)27)18-12-24-13-19-17(18)3-2-4-20(19)25-23(28)14-5-6-14/h7,9,11-14,20H,2-6,8,10H2,1H3,(H,25,28)/t20-/m1/s1
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n/an/an/an/a 2.36E+3n/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
The expression plasmids contains the ORF for either human/cyno CYP11B1 or CYP11B2 under the control of a suitable promoter (CMV-promoter) and a suita...

US Patent US9353081 (2016)


BindingDB Entry DOI: 10.7270/Q2ZW1JT1
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%