PubChem CID |
SMILES |
Binding Protein |
Antagonists(IC50/μM) |
Receptor Protein |
Agonists(EC50/μM) |
Links |
25200942 |
CC(=O)C(=O)[C@@H](CO)O |
- |
- |
LuxP |
30 |
|
70837 |
C1=CC=C(C=C1)C(=O)C2=C(C(=C(C=C2)O)O)O |
LuxP |
4 |
- |
- |
|
57401661 |
C[C@H]([C@H](C(=O)C(=O)C)O)O |
LuxP |
159.7 |
LuxP |
19.5 |
|
25023205 |
CCCCC(=O)C(=O)[C@H](CO)O |
LsrB |
5.04 |
LuxP |
1.01 |
|
57403389 |
C[C@@H]([C@H](C(=O)C(=O)C)O)O |
LuxP |
169 |
LuxP |
0.65 |
|
1057 |
C1=CC(=C(C(=C1)O)O)O |
LuxP |
2 |
- |
- |
|
10706 |
CC(=O)C1=C(C(=C(C=C1)O)O)O |
LuxP |
21 |
- |
- |
|
446576 |
[B-]1(O[C@@]2([C@](O1)([C@H](CO2)O)O)C)(O)O |
LuxP |
* |
- |
- |
|
448719 |
C[C@@]1(C([C@H](CO1)O)(O)O)O |
LsrB |
* |
- |
- |
|
10240835 |
C[C@]1(C(=O)[C@H](CO1)O)O |
LsrB |
* |
- |
- |
|
107428 |
C([C@H]([C@@H]([C@H](C(=O)CO)O)O)O)O |
LsrB |
* |
- |
- |
|
11769098 |
CC(=O)C(=O)OCC1=CC=CC=C1 |
LsrB |
* |
- |
- |
|
124886 |
C(CC(=O)N[C@@H](CS)C(=O)NCC(=O)O)[C@@H](C(=O)O)N |
LsrB |
* |
- |
- |
|
142266 |
CC(=O)CC(=O)OCC1=CC=CC=C1 |
LsrB |
* |
- |
- |
|
21487557 |
CC(C(=O)C(=O)CO)O |
LsrB |
* |
- |
- |
|
24749 |
C(C(C(C(C(C=O)O)O)O)O)O |
LsrB |
* |
- |
- |
|
3037556 |
C([C@H]([C@@H]([C@@H]([C@H](C=O)O)O)O)O)O |
LsrB |
* |
- |
- |
|
34756 |
C[S+](CC[C@@H](C(=O)O)N)C[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O |
LsrB |
* |
- |
- |
|
40467203 |
CCC1(C(=O)[C@@H](CNC1=O)C)CC |
LsrB |
* |
- |
- |
|
439155 |
C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CSCC[C@@H](C(=O)O)N)O)O)N |
LsrB |
* |
- |
- |
|
439357 |
C([C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)O)O)O)O)O |
LsrB |
* |
- |
- |
|
44123585 |
C[C@]1(C([C@H](CO1)O)(O)O)O |
LsrB |
* |
- |
- |
|
453 |
C(C(C(C(C(CO)O)O)O)O)O |
LsrB |
* |
- |
- |
|
54046701 |
C(CSC1[C@@H]([C@@H]([C@H](O1)CO)O)O)[C@@H](C(=O)O)N |
LsrB |
* |
- |
- |
|
54468493 |
C1COC(C1(O)O)(O)O |
LsrB |
* |
- |
- |
|
57494909 |
C(CSC1[C@@H]([C@@H]([C@H](O1)CO)O)O)[C@H](C(=O)O)N |
LsrB |
* |
- |
- |
|
57721036 |
CC1(C([C@H](CO1)O)(O)O)C |
LsrB |
* |
- |
- |
|
6101 |
CC1=CC=C(C=C1)S(=O)(=O)O |
LsrB |
* |
- |
- |
|
656894 |
CC(C)S[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O |
LsrB |
* |
- |
- |
|
6925 |
CC1=CC=CC=C1S(=O)(=O)O |
LsrB |
* |
- |
- |
|
7427 |
C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)O)O |
LsrB |
* |
- |
- |
|
745 |
C(CC(=O)NC(CS)C(=O)NCC(=O)O)C(C(=O)O)N |
LsrB |
* |
- |
- |
|
7532 |
C1=CC=C(C=C1)CS(=O)(=O)O |
LsrB |
* |
- |
- |
|
778 |
C(CS)C(C(=O)O)N |
LsrB |
* |
- |
- |
|
779 |
C(CO)C(C(=O)O)N |
LsrB |
* |
- |
- |
|
8404 |
C1CCC2=CC=CC=C2C1 |
LsrB |
* |
- |
- |
|
8452 |
C1CCC(=O)C1 |
LsrB |
* |
- |
- |
|
9865603 |
C[S+](CCC(C(=O)[O-])N)C[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O |
LsrB |
* |
- |
- |
|
ZINC000008214560(5363269) |
CCCCCCCC/C=C\CCCCCCCC(=O)OCC |
LsrB |
* |
- |
- |
|
ZINC000059868199(5364430) |
CCCCCCCC/C=C/CCCCCCCC(=O)OCC |
LsrB |
* |
- |
- |
|
25023206 |
CCCCCCC(=O)C(=O)[C@H](CO)O |
LsrB |
24.9 |
LuxP |
1.52 |
|
4529307 |
C1=C(C(=C(C(=C1[N+](=O)[O-])O)O)O)[N+](=O)[O-] |
LuxP |
3 |
- |
- |
|
25023204 |
CCCC(=O)C(=O)[C@H](CO)O |
LsrB |
5.3 |
LuxP |
0.75 |
|
11170991 |
CC(=O)C(=O)[C@H](CO)O |
- |
- |
LuxP |
0.032 |
|
57394679 |
C[C@H]([C@@H](C(=O)C(=O)C)O)O |
- |
- |
LuxP |
26.5 |
|
83651 |
C1=C(C=C(C(=C1O)O)O)C=O |
LuxP |
12 |
- |
- |
|
75064 |
C1=CC(=C(C(=C1C=O)O)O)O |
LuxP |
4 |
- |
- |
|
11874 |
C1=CC(=C(C(=C1C(=O)O)O)O)O |
LuxP |
61 |
- |
- |
|
45267702 |
CCCCCCCC(=O)C(=O)[C@H](CO)O |
- |
- |
LuxP |
1.81 |
|
57392938 |
C[C@@H]([C@@H](C(=O)C(=O)C)O)O |
LuxP |
57.54 |
LuxP |
6.21 |
|
5280569 |
C1=CC(=C(C2=C1C=CC(=O)O2)O)O |
LuxP |
12 |
- |
- |
|
370 |
C1=C(C=C(C(=C1O)O)O)C(=O)O |
LuxP |
* |
- |
- |
|
289 |
C1=CC=C(C(=C1)O)O |
LuxP |
* |
- |
- |
|
57399882 |
C([C@@H](C(=O)C(=O)C(F)(F)F)O)O |
- |
- |
LuxP |
30 |
|
2061 |
C1=C(C=C(C(=C1O)O)O)C=C(C#N)C#N |
LuxP |
3 |
- |
- |
|
122187653 |
C1=CC=C2C=C(C=CC2=C1)CC(=O)C(=O)[C@H](CO)O |
LuxP |
* |
- |
- |
|
25023203 |
CCC(=O)C(=O)[C@H](CO)O |
LsrB |
50 |
LuxP |
0.58 |
|
45267703 |
CCCCCC(=O)C(=O)[C@H](CO)O |
LsrB |
5 |
LuxP |
1.35 |
|
9839657 |
CCCCC1=C(/C(=C/Br)/OC1=O)Br |
LuxP, LsrB, LuxR |
1.362, 23.12, 45 |
- |
- |
|
9796693 |
CCCCC1=C(/C(=C\Br)/OC1=O)Br |
against methicillin-resistant E.coli |
- |
- |
- |
|
362385 |
CCCCC1=C(C(=C(Br)Br)OC1=O)Br |
LuxP |
14.36 |
- |
- |
|
9815158 |
CCCCC1=CC(=C(Br)Br)OC1=O |
LuxP, LsrB |
18.9, 148 |
- |
- |
|
21636733 |
CCCCCCC1=CC(=C(Br)Br)OC1=O |
LuxP, LsrB |
84.05, 160.1 |
- |
- |
|
52941579 |
CCCCCCC1=C/C(=C/Br)/OC1=O |
LuxR, LsrB |
3, 1000 |
- |
- |
|
9854058 |
CCCCCC(C1=CC(=C(Br)Br)OC1=O)Br |
LuxR, LsrB |
*, * |
- |
- |
|
9854059 |
CCCCCC(C1=C(/C(=C/Br)/OC1=O)Br)Br |
LuxP, LsrB |
5.207, 3.235 |
- |
- |
|
9865120 |
CCCC(C1=CC(=C(Br)Br)OC1=O)Br |
LuxP, LsrB |
0.1999, 1.31 |
- |
- |
|
21024128 |
CCCC(C1=C(/C(=C/Br)/OC1=O)Br)Br |
LuxP, LsrB |
1.18, 5.714 |
- |
- |
|
16127328 |
CCCCCCC1=C(/C(=C/Br)/OC1=O)Br |
LuxP, LsrB |
11.91, 10.74 |
- |
- |
|
9996453 |
CCC[C@H](C1=C(/C(=C\Br)/OC1=O)Br)O |
against methicillin-resistant E.coli |
- |
- |
- |
|
11057673 |
CCCC(C1=C(/C(=C/Br)/OC1=O)Br)OC(=O)C |
LuxP, LsrB |
50.05, 147.2 |
- |
- |
|
10090405 |
CCC[C@H](C1=C(/C(=C\Br)/OC1=O)Br)OC(=O)C |
against methicillin-resistant E.coli |
- |
- |
- |
|
21729106 |
CCC[C@H](C1=C(C(=C(Br)Br)OC1=O)Br)O |
against methicillin-resistant E.coli |
- |
- |
- |
|
21729107 |
CCC[C@H](C1=C(/C(=C/I)/OC1=O)Br)O |
against methicillin-resistant E.coli |
- |
- |
- |
|
44583901 |
CCC[C@H](C1=C(/C(=C/Cl)/OC1=O)Br)O |
against methicillin-resistant E.coli |
- |
- |
- |
|
6475696 |
CCC[C@H](C1=C(/C(=C/Br)/OC1=O)Br)O |
against methicillin-resistant E.coli |
- |
- |
- |
|
6475695 |
CCC[C@H](C1=C(/C(=C/Br)/OC1=O)Br)OC(=O)C |
against methicillin-resistant E.coli |
- |
- |
- |
|
21729104 |
CCC[C@H](C1=C(/C(=C/I)/OC1=O)Br)OC(=O)C |
against methicillin-resistant E.coli |
- |
- |
- |
|
9877509 |
C\1=CC(=O)O/C1=C\Br |
LuxP |
4.071 |
- |
- |
|
10131246 |
C1=C(/C(=C/Br)/OC1=O)Br |
LuxP, LasR |
2.708, * |
- |
- |
|
315069 |
C1=CC(=O)OC1=C(Br)Br |
LuxP |
2.878 |
- |
- |
|
44447104 |
C(C1=C(/C(=C/Br)/OC1=O)Br)Br |
LasR, LuxP |
*, * |
- |
- |
|
11140550 |
CCC1=CC(=C(Br)Br)OC1=O |
LuxP, LsrB |
104.6, 199.9 |
- |
- |
|
12051732 |
CCC1=C(/C(=C/Br)/OC1=O)Br |
LuxP, LsrB |
9.268, 17.91 |
- |
- |
|
21636735 |
CCC1=C(C(=C(Br)Br)OC1=O)Br |
LuxP, LsrB |
1.152, 57.46 |
- |
- |
|