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There are 5 purchasable compounds for target: Alkanal monooxygenase alpha chain

Wt: 241.2
BDBM65977
Purchase
Wt: 377.4
BDBM65978
Purchase
Wt: 321.2
BDBM65979
Purchase
Wt: 341.2
BDBM65980
Purchase
Wt: 445.4
BDBM64221
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 65977,65978,65979,65980,64221   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Alkanal monooxygenase alpha chain


(Vibrio harveyi)
BDBM65977
PNG
(1-ethenyl-5-(4-ethylphenyl)-2-pyrrolecarboxylic ac...)
Show SMILES CCc1ccc(cc1)-c1ccc(C(O)=O)n1C=C
Show InChI InChI=1S/C15H15NO2/c1-3-11-5-7-12(8-6-11)13-9-10-14(15(17)18)16(13)4-2/h4-10H,2-3H2,1H3,(H,17,18)
PDB
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UniProtKB/SwissProt

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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>1.60E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Quorum Sensing,Auto-inducer 2(AI-2),Vibrio harveyi,LuxS,LuxPQ,LuxO,LuxU,luciferase,Luminescence Assay Overview: A modified strain of Vibri...


Citation and Details
More data for this
Ligand-Target Pair
Alkanal monooxygenase alpha chain


(Vibrio harveyi)
BDBM64221
PNG
(2-(2,5-diketo-4,4-diphenyl-imidazolidin-1-yl)-N-(3...)
Show SMILES COc1cc(NC(=O)CN2C(=O)NC(C2=O)(c2ccccc2)c2ccccc2)cc(OC)c1
Show InChI InChI=1S/C25H23N3O5/c1-32-20-13-19(14-21(15-20)33-2)26-22(29)16-28-23(30)25(27-24(28)31,17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-15H,16H2,1-2H3,(H,26,29)(H,27,31)
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UniChem

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PCBioAssay
n/an/an/an/a>1.60E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Quorum Sensing, LuxPQ receptor, AI-2 Assay Overview: The overall aim of the project is to identify inhibitors of the quorum sensing pathwa...


Citation and Details
More data for this
Ligand-Target Pair
Alkanal monooxygenase alpha chain


(Vibrio harveyi)
BDBM65979
PNG
(1-methyl-N-[4-(trifluoromethoxy)phenyl]-1H-imidazo...)
Show SMILES Cn1cnc(c1)S(=O)(=O)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C11H10F3N3O3S/c1-17-6-10(15-7-17)21(18,19)16-8-2-4-9(5-3-8)20-11(12,13)14/h2-7,16H,1H3
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>1.60E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Quorum Sensing,Auto-inducer 2(AI-2),Vibrio harveyi,LuxS,LuxPQ,LuxO,LuxU,luciferase,Luminescence Assay Overview: A modified strain of Vibri...


Citation and Details
More data for this
Ligand-Target Pair
Alkanal monooxygenase alpha chain


(Vibrio harveyi)
BDBM65980
PNG
(MLS001211346 | N-(5-Bromo-pyridin-2-yl)-4-ethyl-be...)
Show SMILES CCc1ccc(cc1)S(=O)(=O)Nc1ccc(Br)cn1
Show InChI InChI=1S/C13H13BrN2O2S/c1-2-10-3-6-12(7-4-10)19(17,18)16-13-8-5-11(14)9-15-13/h3-9H,2H2,1H3,(H,15,16)
PDB
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PC sid
UniChem
PCBioAssay
n/an/an/an/a>1.60E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Quorum Sensing,Auto-inducer 2(AI-2),Vibrio harveyi,LuxS,LuxPQ,LuxO,LuxU,luciferase,Luminescence Assay Overview: A modified strain of Vibri...


Citation and Details
More data for this
Ligand-Target Pair
Alkanal monooxygenase alpha chain


(Vibrio harveyi)
BDBM64221
PNG
(2-(2,5-diketo-4,4-diphenyl-imidazolidin-1-yl)-N-(3...)
Show SMILES COc1cc(NC(=O)CN2C(=O)NC(C2=O)(c2ccccc2)c2ccccc2)cc(OC)c1
Show InChI InChI=1S/C25H23N3O5/c1-32-20-13-19(14-21(15-20)33-2)26-22(29)16-28-23(30)25(27-24(28)31,17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-15H,16H2,1-2H3,(H,26,29)(H,27,31)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
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PC cid
PC sid
UniChem

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PCBioAssay
n/an/an/an/a>1.60E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Quorum Sensing,Auto-inducer 2(AI-2),Vibrio harveyi,LuxS,LuxPQ,LuxO,LuxU,luciferase,Luminescence Assay Overview: A modified strain of Vibri...


Citation and Details
More data for this
Ligand-Target Pair
Alkanal monooxygenase alpha chain


(Vibrio harveyi)
BDBM65977
PNG
(1-ethenyl-5-(4-ethylphenyl)-2-pyrrolecarboxylic ac...)
Show SMILES CCc1ccc(cc1)-c1ccc(C(O)=O)n1C=C
Show InChI InChI=1S/C15H15NO2/c1-3-11-5-7-12(8-6-11)13-9-10-14(15(17)18)16(13)4-2/h4-10H,2-3H2,1H3,(H,17,18)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
Article
PCBioAssay
n/an/an/an/a 2.58E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Quorum Sensing, Auto-inducer 2 (AI-2), Vibrio harveyi, LuxS,LuxPQ,LuxO,LuxU,LuxR,luciferase,Luminescence Assay Overview: A modified strain ...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
Alkanal monooxygenase alpha chain


(Vibrio harveyi)
BDBM65978
PNG
(MLS000690454 | N-[({4-[(dimethylamino)sulfonyl]phe...)
Show SMILES CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)Cc2ccccc2)cc1
Show InChI InChI=1S/C17H19N3O3S2/c1-20(2)25(22,23)15-10-8-14(9-11-15)18-17(24)19-16(21)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H2,18,19,21,24)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
Article
PCBioAssay
n/an/an/an/a>1.60E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Quorum Sensing, Auto-inducer 2 (AI-2), Vibrio harveyi, LuxS,LuxPQ,LuxO,LuxU,LuxR,luciferase,Luminescence Assay Overview: A modified strain ...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
Alkanal monooxygenase alpha chain


(Vibrio harveyi)
BDBM65979
PNG
(1-methyl-N-[4-(trifluoromethoxy)phenyl]-1H-imidazo...)
Show SMILES Cn1cnc(c1)S(=O)(=O)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C11H10F3N3O3S/c1-17-6-10(15-7-17)21(18,19)16-8-2-4-9(5-3-8)20-11(12,13)14/h2-7,16H,1H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
Article
PCBioAssay
n/an/an/an/a 2.45E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Quorum Sensing, Auto-inducer 2 (AI-2), Vibrio harveyi, LuxS,LuxPQ,LuxO,LuxU,LuxR,luciferase,Luminescence Assay Overview: A modified strain ...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
Alkanal monooxygenase alpha chain


(Vibrio harveyi)
BDBM65980
PNG
(MLS001211346 | N-(5-Bromo-pyridin-2-yl)-4-ethyl-be...)
Show SMILES CCc1ccc(cc1)S(=O)(=O)Nc1ccc(Br)cn1
Show InChI InChI=1S/C13H13BrN2O2S/c1-2-10-3-6-12(7-4-10)19(17,18)16-13-8-5-11(14)9-15-13/h3-9H,2H2,1H3,(H,15,16)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PCBioAssay
n/an/an/an/a 1.82E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Quorum Sensing, Auto-inducer 2 (AI-2), Vibrio harveyi, LuxS,LuxPQ,LuxO,LuxU,LuxR,luciferase,Luminescence Assay Overview: A modified strain ...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
Alkanal monooxygenase alpha chain


(Vibrio harveyi)
BDBM64221
PNG
(2-(2,5-diketo-4,4-diphenyl-imidazolidin-1-yl)-N-(3...)
Show SMILES COc1cc(NC(=O)CN2C(=O)NC(C2=O)(c2ccccc2)c2ccccc2)cc(OC)c1
Show InChI InChI=1S/C25H23N3O5/c1-32-20-13-19(14-21(15-20)33-2)26-22(29)16-28-23(30)25(27-24(28)31,17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-15H,16H2,1-2H3,(H,26,29)(H,27,31)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem

Similars

Article
PCBioAssay
n/an/an/an/a 1.00E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Quorum Sensing, Auto-inducer 2 (AI-2), Vibrio harveyi, LuxS,LuxPQ,LuxO,LuxU,LuxR,luciferase,Luminescence Assay Overview: A modified strain ...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
Alkanal monooxygenase alpha chain


(Vibrio harveyi)
BDBM65977
PNG
(1-ethenyl-5-(4-ethylphenyl)-2-pyrrolecarboxylic ac...)
Show SMILES CCc1ccc(cc1)-c1ccc(C(O)=O)n1C=C
Show InChI InChI=1S/C15H15NO2/c1-3-11-5-7-12(8-6-11)13-9-10-14(15(17)18)16(13)4-2/h4-10H,2-3H2,1H3,(H,17,18)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>1.60E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Quorum Sensing, LuxPQ receptor, AI-2 Assay Overview: The overall aim of the project is to identify inhibitors of the quorum sensing pathwa...


Citation and Details
More data for this
Ligand-Target Pair
Alkanal monooxygenase alpha chain


(Vibrio harveyi)
BDBM65978
PNG
(MLS000690454 | N-[({4-[(dimethylamino)sulfonyl]phe...)
Show SMILES CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)Cc2ccccc2)cc1
Show InChI InChI=1S/C17H19N3O3S2/c1-20(2)25(22,23)15-10-8-14(9-11-15)18-17(24)19-16(21)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H2,18,19,21,24)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>1.60E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Quorum Sensing, LuxPQ receptor, AI-2 Assay Overview: The overall aim of the project is to identify inhibitors of the quorum sensing pathwa...


Citation and Details
More data for this
Ligand-Target Pair
Alkanal monooxygenase alpha chain


(Vibrio harveyi)
BDBM65979
PNG
(1-methyl-N-[4-(trifluoromethoxy)phenyl]-1H-imidazo...)
Show SMILES Cn1cnc(c1)S(=O)(=O)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C11H10F3N3O3S/c1-17-6-10(15-7-17)21(18,19)16-8-2-4-9(5-3-8)20-11(12,13)14/h2-7,16H,1H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>1.60E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Quorum Sensing, LuxPQ receptor, AI-2 Assay Overview: The overall aim of the project is to identify inhibitors of the quorum sensing pathwa...


Citation and Details
More data for this
Ligand-Target Pair
Alkanal monooxygenase alpha chain


(Vibrio harveyi)
BDBM65980
PNG
(MLS001211346 | N-(5-Bromo-pyridin-2-yl)-4-ethyl-be...)
Show SMILES CCc1ccc(cc1)S(=O)(=O)Nc1ccc(Br)cn1
Show InChI InChI=1S/C13H13BrN2O2S/c1-2-10-3-6-12(7-4-10)19(17,18)16-13-8-5-11(14)9-15-13/h3-9H,2H2,1H3,(H,15,16)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>1.60E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Quorum Sensing, LuxPQ receptor, AI-2 Assay Overview: The overall aim of the project is to identify inhibitors of the quorum sensing pathwa...


Citation and Details
More data for this
Ligand-Target Pair
Alkanal monooxygenase alpha chain


(Vibrio harveyi)
BDBM65978
PNG
(MLS000690454 | N-[({4-[(dimethylamino)sulfonyl]phe...)
Show SMILES CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)Cc2ccccc2)cc1
Show InChI InChI=1S/C17H19N3O3S2/c1-20(2)25(22,23)15-10-8-14(9-11-15)18-17(24)19-16(21)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H2,18,19,21,24)
PDB
MMDB

UniProtKB/SwissProt

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GoogleScholar
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>1.60E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Quorum Sensing,Auto-inducer 2(AI-2),Vibrio harveyi,LuxS,LuxPQ,LuxO,LuxU,luciferase,Luminescence Assay Overview: A modified strain of Vibri...


Citation and Details
More data for this
Ligand-Target Pair