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Compile Data Set for Download or QSAR

Found 51 hits Enz. Inhib. hit(s) with Target = 'CAI-1 autoinducer sensor kinase/phosphatase CqsS'   
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
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358387
PNG
(CHEMBL1922879)
Show SMILES CCCCCCCCCC(=O)C(O)c1cccc(O)c1
Show InChI InChI=1S/C17H26O3/c1-2-3-4-5-6-7-8-12-16(19)17(20)14-10-9-11-15(18)13-14/h9-11,13,17-18,20H,2-8,12H2,1H3
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n/an/a 3.60E+4n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358381
PNG
(CHEMBL1922873)
Show SMILES CCCCCCCCCC(=O)C(O)c1cccc(C)c1
Show InChI InChI=1S/C18H28O2/c1-3-4-5-6-7-8-9-13-17(19)18(20)16-12-10-11-15(2)14-16/h10-12,14,18,20H,3-9,13H2,1-2H3
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n/an/a 4.60E+4n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358379
PNG
(CHEMBL1922871)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccccc1
Show InChI InChI=1S/C17H26O2/c1-2-3-4-5-6-7-11-14-16(18)17(19)15-12-9-8-10-13-15/h8-10,12-13,17,19H,2-7,11,14H2,1H3
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n/an/a 5.50E+4n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358421
PNG
(CHEMBL1922888)
Show SMILES CCCCCCCCCC(=O)C(O)c1cc(F)ccc1F
Show InChI InChI=1S/C17H24F2O2/c1-2-3-4-5-6-7-8-9-16(20)17(21)14-12-13(18)10-11-15(14)19/h10-12,17,21H,2-9H2,1H3
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n/an/a 6.80E+4n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358418
PNG
(CHEMBL1922885)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccccc1F
Show InChI InChI=1S/C17H25FO2/c1-2-3-4-5-6-7-8-13-16(19)17(20)14-11-9-10-12-15(14)18/h9-12,17,20H,2-8,13H2,1H3
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n/an/a 7.40E+4n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358388
PNG
(CHEMBL1922880)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccc(O)cc1
Show InChI InChI=1S/C17H26O3/c1-2-3-4-5-6-7-8-9-16(19)17(20)14-10-12-15(18)13-11-14/h10-13,17-18,20H,2-9H2,1H3
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n/an/a 7.80E+4n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358382
PNG
(CHEMBL1922874)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccc(C)cc1
Show InChI InChI=1S/C18H28O2/c1-3-4-5-6-7-8-9-10-17(19)18(20)16-13-11-15(2)12-14-16/h11-14,18,20H,3-10H2,1-2H3
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n/an/a 1.14E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358428
PNG
(CHEMBL1922895)
Show SMILES CCCCCCCCCC(=O)C(O)Cc1ccccc1
Show InChI InChI=1S/C18H28O2/c1-2-3-4-5-6-7-11-14-17(19)18(20)15-16-12-9-8-10-13-16/h8-10,12-13,18,20H,2-7,11,14-15H2,1H3
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n/an/a 1.36E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358420
PNG
(CHEMBL1922887)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccc(F)cc1
Show InChI InChI=1S/C17H25FO2/c1-2-3-4-5-6-7-8-9-16(19)17(20)14-10-12-15(18)13-11-14/h10-13,17,20H,2-9H2,1H3
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n/an/a 1.37E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358386
PNG
(CHEMBL1922878)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccccc1O
Show InChI InChI=1S/C17H26O3/c1-2-3-4-5-6-7-8-13-16(19)17(20)14-11-9-10-12-15(14)18/h9-12,17-18,20H,2-8,13H2,1H3
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n/an/a 1.72E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358389
PNG
(CHEMBL1922881)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C17H26O4/c1-2-3-4-5-6-7-8-9-15(19)17(21)13-10-11-14(18)16(20)12-13/h10-12,17-18,20-21H,2-9H2,1H3
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n/an/a 1.74E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358419
PNG
(CHEMBL1922886)
Show SMILES CCCCCCCCCC(=O)C(O)c1cccc(F)c1
Show InChI InChI=1S/C17H25FO2/c1-2-3-4-5-6-7-8-12-16(19)17(20)14-10-9-11-15(18)13-14/h9-11,13,17,20H,2-8,12H2,1H3
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n/an/a 1.78E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358427
PNG
(CHEMBL1922894)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccc(Br)cc1
Show InChI InChI=1S/C17H25BrO2/c1-2-3-4-5-6-7-8-9-16(19)17(20)14-10-12-15(18)13-11-14/h10-13,17,20H,2-9H2,1H3
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n/an/a 1.85E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358391
PNG
(CHEMBL1922883)
Show SMILES CCCCCCCCCC(=O)C(O)c1cccc(OC)c1
Show InChI InChI=1S/C18H28O3/c1-3-4-5-6-7-8-9-13-17(19)18(20)15-11-10-12-16(14-15)21-2/h10-12,14,18,20H,3-9,13H2,1-2H3
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n/an/a>5.00E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358390
PNG
(CHEMBL1922882)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccccc1OC
Show InChI InChI=1S/C18H28O3/c1-3-4-5-6-7-8-9-13-16(19)18(20)15-12-10-11-14-17(15)21-2/h10-12,14,18,20H,3-9,13H2,1-2H3
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n/an/a>5.00E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358385
PNG
(CHEMBL1922877)
Show SMILES CCCCCCCCCC(=O)C(O)c1cccc(CCC)c1
Show InChI InChI=1S/C20H32O2/c1-3-5-6-7-8-9-10-15-19(21)20(22)18-14-11-13-17(16-18)12-4-2/h11,13-14,16,20,22H,3-10,12,15H2,1-2H3
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n/an/a>5.00E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358384
PNG
(CHEMBL1922876)
Show SMILES CCCCCCCCCC(=O)C(O)c1cccc(CC)c1
Show InChI InChI=1S/C19H30O2/c1-3-5-6-7-8-9-10-14-18(20)19(21)17-13-11-12-16(4-2)15-17/h11-13,15,19,21H,3-10,14H2,1-2H3
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n/an/a>5.00E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358383
PNG
(CHEMBL1922875)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccc(C)c(C)c1
Show InChI InChI=1S/C19H30O2/c1-4-5-6-7-8-9-10-11-18(20)19(21)17-13-12-15(2)16(3)14-17/h12-14,19,21H,4-11H2,1-3H3
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n/an/a>5.00E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358429
PNG
(CHEMBL1922896)
Show SMILES CCCCCCCCCC(=O)C(N)c1ccccc1
Show InChI InChI=1S/C17H27NO/c1-2-3-4-5-6-7-11-14-16(19)17(18)15-12-9-8-10-13-15/h8-10,12-13,17H,2-7,11,14,18H2,1H3
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n/an/a>5.00E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358380
PNG
(CHEMBL1922872)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccccc1C
Show InChI InChI=1S/C18H28O2/c1-3-4-5-6-7-8-9-14-17(19)18(20)16-13-11-10-12-15(16)2/h10-13,18,20H,3-9,14H2,1-2H3
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n/an/a>5.00E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358426
PNG
(CHEMBL1922893)
Show SMILES CCCCCCCCCC(=O)C(O)c1cccc(Br)c1
Show InChI InChI=1S/C17H25BrO2/c1-2-3-4-5-6-7-8-12-16(19)17(20)14-10-9-11-15(18)13-14/h9-11,13,17,20H,2-8,12H2,1H3
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n/an/a>5.00E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358425
PNG
(CHEMBL1922892)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccccc1Br
Show InChI InChI=1S/C17H25BrO2/c1-2-3-4-5-6-7-8-13-16(19)17(20)14-11-9-10-12-15(14)18/h9-12,17,20H,2-8,13H2,1H3
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n/an/a>5.00E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358424
PNG
(CHEMBL1922891)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H25ClO2/c1-2-3-4-5-6-7-8-9-16(19)17(20)14-10-12-15(18)13-11-14/h10-13,17,20H,2-9H2,1H3
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n/an/a>5.00E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358423
PNG
(CHEMBL1922890)
Show SMILES CCCCCCCCCC(=O)C(O)c1cccc(Cl)c1
Show InChI InChI=1S/C17H25ClO2/c1-2-3-4-5-6-7-8-12-16(19)17(20)14-10-9-11-15(18)13-14/h9-11,13,17,20H,2-8,12H2,1H3
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n/an/a>5.00E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358422
PNG
(CHEMBL1922889)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccccc1Cl
Show InChI InChI=1S/C17H25ClO2/c1-2-3-4-5-6-7-8-13-16(19)17(20)14-11-9-10-12-15(14)18/h9-12,17,20H,2-8,13H2,1H3
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n/an/a>5.00E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358417
PNG
(CHEMBL1922884)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccc(OC)cc1
Show InChI InChI=1S/C18H28O3/c1-3-4-5-6-7-8-9-10-17(19)18(20)15-11-13-16(21-2)14-12-15/h11-14,18,20H,3-10H2,1-2H3
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n/an/a>5.00E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358405
PNG
(CHEMBL1922857)
Show SMILES CCCCCCCCCC(O)C(O)CC
Show InChI InChI=1S/C13H28O2/c1-3-5-6-7-8-9-10-11-13(15)12(14)4-2/h12-15H,3-11H2,1-2H3
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n/an/an/an/a 4.30E+3n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358398
PNG
(CHEMBL1922864)
Show SMILES CCCCCCCCCC(=O)C(Br)CC
Show InChI InChI=1S/C13H25BrO/c1-3-5-6-7-8-9-10-11-13(15)12(14)4-2/h12H,3-11H2,1-2H3
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n/an/an/an/a 2.40E+3n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358407
PNG
(CHEMBL1922855)
Show SMILES CCCCCCCCCCCCC(=O)[C@@H](O)CC
Show InChI InChI=1S/C16H32O2/c1-3-5-6-7-8-9-10-11-12-13-14-16(18)15(17)4-2/h15,17H,3-14H2,1-2H3/t15-/m0/s1
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n/an/an/an/a>5.00E+4n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358408
PNG
(CHEMBL1922854)
Show SMILES CCCCCCCCCCC(=O)[C@@H](O)CC
Show InChI InChI=1S/C14H28O2/c1-3-5-6-7-8-9-10-11-12-14(16)13(15)4-2/h13,15H,3-12H2,1-2H3/t13-/m0/s1
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n/an/an/an/a 2.09E+3n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358409
PNG
(CHEMBL1922853)
Show SMILES CCCCCCCCCC(=O)[C@H](O)CC
Show InChI InChI=1S/C13H26O2/c1-3-5-6-7-8-9-10-11-13(15)12(14)4-2/h12,14H,3-11H2,1-2H3/t12-/m1/s1
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n/an/an/an/a 640n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358410
PNG
(CHEMBL1922852)
Show SMILES CCCCCCCCCC(=O)[C@@H](O)CC
Show InChI InChI=1S/C13H26O2/c1-3-5-6-7-8-9-10-11-13(15)12(14)4-2/h12,14H,3-11H2,1-2H3/t12-/m0/s1
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n/an/an/an/a 250n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358411
PNG
(CHEMBL1922851)
Show SMILES CCCCCCCCC(=O)[C@H](O)CC
Show InChI InChI=1S/C12H24O2/c1-3-5-6-7-8-9-10-12(14)11(13)4-2/h11,13H,3-10H2,1-2H3/t11-/m1/s1
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n/an/an/an/a 1.61E+3n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358412
PNG
(CHEMBL1922850)
Show SMILES CCCCCCCCC(=O)[C@@H](O)CC
Show InChI InChI=1S/C12H24O2/c1-3-5-6-7-8-9-10-12(14)11(13)4-2/h11,13H,3-10H2,1-2H3/t11-/m0/s1
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n/an/an/an/a 1.10E+3n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358413
PNG
(CHEMBL1922849)
Show SMILES CCCCCCCC(=O)[C@H](O)CC
Show InChI InChI=1S/C11H22O2/c1-3-5-6-7-8-9-11(13)10(12)4-2/h10,12H,3-9H2,1-2H3/t10-/m1/s1
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n/an/an/an/a 6.60E+3n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358414
PNG
(CHEMBL1922848)
Show SMILES CCCCCCCC(=O)[C@@H](O)CC
Show InChI InChI=1S/C11H22O2/c1-3-5-6-7-8-9-11(13)10(12)4-2/h10,12H,3-9H2,1-2H3/t10-/m0/s1
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n/an/an/an/a 9.45E+3n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358415
PNG
(CHEMBL1922847)
Show SMILES CCCCCCC(=O)[C@@H](O)CC
Show InChI InChI=1S/C10H20O2/c1-3-5-6-7-8-10(12)9(11)4-2/h9,11H,3-8H2,1-2H3/t9-/m0/s1
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n/an/an/an/a>5.00E+4n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358416
PNG
(CHEMBL1922846)
Show SMILES CCCCCC(=O)[C@@H](O)CC
Show InChI InChI=1S/C9H18O2/c1-3-5-6-7-9(11)8(10)4-2/h8,10H,3-7H2,1-2H3/t8-/m0/s1
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n/an/an/an/a>5.00E+4n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358393
PNG
(CHEMBL1922869)
Show SMILES CCCCCCCCCC(=O)C(O)C(C)C
Show InChI InChI=1S/C14H28O2/c1-4-5-6-7-8-9-10-11-13(15)14(16)12(2)3/h12,14,16H,4-11H2,1-3H3
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n/an/an/an/a 7.16E+3n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358397
PNG
(CHEMBL1922865)
Show SMILES CCCCCCCCCC(=O)C(S)CC
Show InChI InChI=1S/C13H26OS/c1-3-5-6-7-8-9-10-11-12(14)13(15)4-2/h13,15H,3-11H2,1-2H3
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n/an/an/an/a 1.60E+3n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358396
PNG
(CHEMBL1922866)
Show SMILES CCCCCCCCCC(=O)C(N)CC
Show InChI InChI=1S/C13H27NO/c1-3-5-6-7-8-9-10-11-13(15)12(14)4-2/h12H,3-11,14H2,1-2H3
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n/an/an/an/a 210n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358395
PNG
(CHEMBL1922867)
Show SMILES CCCCCCCCCC(=O)[C@H](C)O
Show InChI InChI=1S/C12H24O2/c1-3-4-5-6-7-8-9-10-12(14)11(2)13/h11,13H,3-10H2,1-2H3/t11-/m0/s1
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n/an/an/an/a 340n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358394
PNG
(CHEMBL1922868)
Show SMILES CCCCCCCCCC(=O)C(O)CCC
Show InChI InChI=1S/C14H28O2/c1-3-5-6-7-8-9-10-12-14(16)13(15)11-4-2/h13,15H,3-12H2,1-2H3
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n/an/an/an/a 780n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358392
PNG
(CHEMBL1922870)
Show SMILES CCCCCCCCCC(=O)C(O)C(C)(C)C
Show InChI InChI=1S/C15H30O2/c1-5-6-7-8-9-10-11-12-13(16)14(17)15(2,3)4/h14,17H,5-12H2,1-4H3
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n/an/an/an/a>5.00E+4n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358404
PNG
(CHEMBL1922858)
Show SMILES CCCCCCCCCC(O)C(=O)CC
Show InChI InChI=1S/C13H26O2/c1-3-5-6-7-8-9-10-11-13(15)12(14)4-2/h13,15H,3-11H2,1-2H3
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n/an/an/an/a 2.10E+4n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358403
PNG
(CHEMBL1922859)
Show SMILES CCCCCCCCCC(O)CCC
Show InChI InChI=1S/C13H28O/c1-3-5-6-7-8-9-10-12-13(14)11-4-2/h13-14H,3-12H2,1-2H3
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n/an/an/an/a>5.00E+4n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358402
PNG
(CHEMBL1922860)
Show SMILES CCCCCCCCCC(=O)CCC
Show InChI InChI=1S/C13H26O/c1-3-5-6-7-8-9-10-12-13(14)11-4-2/h3-12H2,1-2H3
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n/an/an/an/a>5.00E+4n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358401
PNG
(CHEMBL1922861)
Show SMILES CCCCCCCCCCC(O)CC
Show InChI InChI=1S/C13H28O/c1-3-5-6-7-8-9-10-11-12-13(14)4-2/h13-14H,3-12H2,1-2H3
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n/an/an/an/a>5.00E+4n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358400
PNG
(CHEMBL1922862)
Show SMILES CCCCCCCCCCC(=O)CC
Show InChI InChI=1S/C13H26O/c1-3-5-6-7-8-9-10-11-12-13(14)4-2/h3-12H2,1-2H3
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n/an/an/an/a>5.00E+4n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


Citation and Details
More data for this
Ligand-Target Pair
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358399
PNG
(CHEMBL1922863)
Show SMILES CCCCCCCCCC(=O)C(Cl)CC
Show InChI InChI=1S/C13H25ClO/c1-3-5-6-7-8-9-10-11-13(15)12(14)4-2/h12H,3-11H2,1-2H3
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n/an/an/an/a>5.00E+4n/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Agonist activity at CqsS receptor in cqsA-deficient, luxQ-deficient Vibrio cholerae MM920 harboring cosmid pBB1 carrying Vibrio harveyi luxCDABE gene...


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Ligand-Target Pair
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