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Compile Data Set for Download or QSAR

Found 11 hits of non-affinity data for polymerid = 1023   
Target
(Institution)
LigandTarget
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


(Homo sapiens (human))
BDBM8920
PNG
(3-[6-(Benzyloxy)-2-naphthyl]pyridine | 3-[6-(benzy...)
Show SMILES C(Oc1ccc2cc(ccc2c1)-c1cccnc1)c1ccccc1
Show InChI InChI=1S/C22H17NO/c1-2-5-17(6-3-1)16-24-22-11-10-18-13-19(8-9-20(18)14-22)21-7-4-12-23-15-21/h1-15H,16H2
PDB

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n/an/an/an/an/an/an/a7.437



Saarland University



Assay Description
The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...


Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 11B2


(Homo sapiens (human))
BDBM8921
PNG
(3-(2-methoxy-6-pyridin-3-yl-1-naphthyl)pyridine | ...)
Show SMILES COc1ccc2cc(ccc2c1-c1cccnc1)-c1cccnc1
Show InChI InChI=1S/C21H16N2O/c1-24-20-9-7-16-12-15(17-4-2-10-22-13-17)6-8-19(16)21(20)18-5-3-11-23-14-18/h2-14H,1H3
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n/an/an/an/an/an/an/a7.437



Saarland University



Assay Description
The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...


Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 11B2


(Homo sapiens (human))
BDBM8922
PNG
(3-(3-Methoxy-2-naphthyl)pyridine | 3-(3-methoxynap...)
Show SMILES COc1cc2ccccc2cc1-c1cccnc1
Show InChI InChI=1S/C16H13NO/c1-18-16-10-13-6-3-2-5-12(13)9-15(16)14-7-4-8-17-11-14/h2-11H,1H3
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n/an/an/an/an/an/an/a7.437



Saarland University



Assay Description
The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...


Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 11B2


(Homo sapiens (human))
BDBM8923
PNG
(6-(pyridin-3-yl)naphthalene-2-carboxamide | 6-Pyri...)
Show SMILES NC(=O)c1ccc2cc(ccc2c1)-c1cccnc1
Show InChI InChI=1S/C16H12N2O/c17-16(19)14-6-5-11-8-13(4-3-12(11)9-14)15-2-1-7-18-10-15/h1-10H,(H2,17,19)
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n/an/an/an/an/an/an/a7.437



Saarland University



Assay Description
The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...


Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 11B2


(Homo sapiens (human))
BDBM8924
PNG
(N-Methyl-6-pyridin-3-yl-2-naphthamide | N-methyl-6...)
Show SMILES CNC(=O)c1ccc2cc(ccc2c1)-c1cccnc1
Show InChI InChI=1S/C17H14N2O/c1-18-17(20)15-7-6-12-9-14(5-4-13(12)10-15)16-3-2-8-19-11-16/h2-11H,1H3,(H,18,20)
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n/an/an/an/an/an/an/a7.437



Saarland University



Assay Description
The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...


Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 11B2


(Homo sapiens (human))
BDBM8930
PNG
(4-(6-Methoxy-2-naphthyl)pyridine | 4-(6-methoxynap...)
Show SMILES COc1ccc2cc(ccc2c1)-c1ccncc1
Show InChI InChI=1S/C16H13NO/c1-18-16-5-4-14-10-13(2-3-15(14)11-16)12-6-8-17-9-7-12/h2-11H,1H3
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n/an/an/an/an/an/an/a7.437



Saarland University



Assay Description
The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...


Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 11B2


(Homo sapiens (human))
BDBM8926
PNG
(2-(pyridin-3-yl)quinoline | 2-Pyridin-3-yl-quinoli...)
Show SMILES c1ccc2nc(ccc2c1)-c1cccnc1
Show InChI InChI=1S/C14H10N2/c1-2-6-13-11(4-1)7-8-14(16-13)12-5-3-9-15-10-12/h1-10H
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n/an/an/an/an/an/an/a7.437



Saarland University



Assay Description
The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...


Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 11B2


(Homo sapiens (human))
BDBM8927
PNG
(2-(pyridin-3-yl)quinoxaline | 2-Pyridin-3-yl-quino...)
Show SMILES c1ccc2nc(cnc2c1)-c1cccnc1
Show InChI InChI=1S/C13H9N3/c1-2-6-12-11(5-1)15-9-13(16-12)10-4-3-7-14-8-10/h1-9H
PDB

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n/an/an/an/an/an/an/a7.437



Saarland University



Assay Description
The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...


Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 11B2


(Homo sapiens (human))
BDBM8928
PNG
(5-(2-Naphthyl)-1,3-oxazole | 5-(naphthalen-2-yl)-1...)
Show SMILES c1ncc(o1)-c1ccc2ccccc2c1
Show InChI InChI=1S/C13H9NO/c1-2-4-11-7-12(6-5-10(11)3-1)13-8-14-9-15-13/h1-9H
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n/an/an/an/an/an/an/a7.437



Saarland University



Assay Description
The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...


Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 11B2


(Homo sapiens (human))
BDBM8929
PNG
(5-(6-Methoxy-2-naphthyl)pyrimidine | 5-(6-methoxyn...)
Show SMILES COc1ccc2cc(ccc2c1)-c1cncnc1
Show InChI InChI=1S/C15H12N2O/c1-18-15-5-4-11-6-12(2-3-13(11)7-15)14-8-16-10-17-9-14/h2-10H,1H3
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n/an/an/an/an/an/an/a7.437



Saarland University



Assay Description
The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...


Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 11B2


(Homo sapiens (human))
BDBM8925
PNG
(3-(pyridin-3-yl)quinoline | 3-Pyridin-3-yl-quinoli...)
Show SMILES c1ccc2ncc(cc2c1)-c1cccnc1
Show InChI InChI=1S/C14H10N2/c1-2-6-14-11(4-1)8-13(10-16-14)12-5-3-7-15-9-12/h1-10H
PDB

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Article
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n/an/an/an/an/an/an/a7.437



Saarland University



Assay Description
The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...


Citation and Details
More data for this
Ligand-Target Pair