Model Systems and Decoys
 Share
The version of the browser you are using is no longer supported. Please upgrade to a supported browser.Dismiss

View only
 
 
ABCDEFGHIJKLMNOPQRSTUVWXYZ
1
L99A binders
2
These compounds are known to bind to T4 lysozme L99A:
3
4
namesmileszinciddTM (cels)
kd (µM)
pdbrefs
5
(2-thienylthio)acetoneCC(=O)CSc1cccs1ZINC0000001562171.1Su et al., 2001
6
1-ethyl-2-hydro-1,2-azaborine
CCN1BC=CC=C1ZINC0001980320793HH5Liu et al., 2009
7
1-ethyl-2-methylcyclopentene
CCC1=C(C)CCC1ZINC0000025754371.2Su et al., 2001
8
1-methylpyrroleCn1cccc1ZINC0000016924462.25442OU0Mobley et al., 2007
9
1-phenyl-1-propyneCC#Cc1ccccc1ZINC0000018458413Morton et al., 1995
10
1,2-benzenedithiolSc1ccccc1SZINC0000003885652.5n.a.Mobley et al., 2007
11
1,2-benzisoxazolec1noc2ccccc12ZINC0000045211870.4Morton et al., 1995
12
1,2-dichlorobenzeneClc1ccccc1ClZINC0000003885062.9202OTYMobley et al., 2007
13
1,2-dihydro-1,2-azaborineB1C=CC=CN1ZINC0001980320721973HH3Lee et al., 2016Liu et al., 2009
14
2-(methylthio)thiopheneCSc1cccs1ZINC0000001609283.3Su et al., 2001
15
2-ethoxyphenolCCOc1ccccc1OZINC0000004047471.22RB1Graves et al., 2008
16
2-ethylfuranCCc1ccco1ZINC0000020377261.9Morton et al., 1995
17
2-ethyltolueneCCc1ccccc1CZINC0000015987171.1505.1Morton et al., 1995
18
2-iodopropaneCC(C)IZINC0000020128141.1Morton et al., 1995
19
2-iodotolueneCc1ccccc1IZINC0000016728461.9Morton et al., 1995
20
2-methylbenzofuranCc1cc2ccccc2o1ZINC0000020133441.1Morton et al., 1995
21
2,3-benzofuranc2cc1ccccc1o2ZINC0000015918143112.4182LMorton et al., 1995
22
2,6-difluorobenzylbromideFc1cccc(F)c1CBrZINC0000022425871.62RB0Graves et al., 2008
23
3-ethyltolueneCCc1cccc(C)c1ZINC0000016995601.1198Morton et al., 1995
24
3-iodotolueneCc1cccc(c1)IZINC0000016728472Morton et al., 1995
25
3-methylbenzylazideCc1cccc(CN=[N+]=[N-])c1ZINC0000154431261.52RB2Graves et al., 2008
26
3-phenyl-1-propanethiolSCCCc1ccccc1ZINC0000051389754.5Morton et al., 1995
27
3-phenyl-1-propanolOCCCc1ccccc1ZINC0000017478391Morton et al., 1995
28
4-(methylthio)nitrobenzeneCSc1ccc([N+](=O)[O-])cc1ZINC0000001633561.32RAZGraves et al., 2008
29
4-ethyltolueneCCc1ccc(C)cc1ZINC0000016995611.7120Morton et al., 1995
30
4-iodotolueneCc1ccc(I)cc1ZINC0000010037501.3Morton et al., 1995
31
6-methyl-1,5,heptadieneC=CCCC=C(C)CZINC0000025633752.8n.a.Graves et al., 2008
32
allyl ethyl sulfideCCSCC=CZINC0000021664761.9Morton et al., 1995
33
allyl n-propyletherCCCOCC=CZINC0000016017991.6Morton et al., 1995
34
allyl sulfideC=CCSCC=CZINC0000015310831.9Morton et al., 1995
35
anisoleCOc1ccccc1ZINC0000008971311.4Morton et al., 1995
36
b-et-1,2-azaborineCCB1C=CC=CN1ZINC0005849047401725JWSLee et al., 2016
37
benzenec1ccccc1ZINC0000009675325.985 , 175 4W52, 3HH4, 181LLee et al., 2016
Merski et al., 2014
Liu et al., 2009
Eriksson et al., 1992
38
benzyl mercaptanSCc1ccccc1ZINC0000038736472.1Morton et al., 1995
39
beta-chlorophenetoleClCCOc1ccccc1ZINC0000015878156.52RAYGraves et al., 2008
40
bromoethaneCCBrZINC0000139509132.4Morton et al., 1995
41
cis-3-hexenyl formateCC/C=C\CCOC=OZINC0000144387011.5n.a.Graves et al., 2008
42
cyclohexeneC1CCC=CC1ZINC0000139509111Morton et al., 1995
43
diethyl disulfideCCSSCCZINC0000016482643.5Morton et al., 1995
44
diisopropyl disulfideCC(C)SSC(C)CZINC0000016740780.7Morton et al., 1995
45
dipropyl disulfideCCCSSCCCZINC0000015310842Morton et al., 1995
46
ethylbenzeneCCc1ccccc1ZINC00000096827085 , 68 4W54, 3HH6Lee et al., 2016
Merski et al., 2014
Liu et al., 2009Morton et al., 1995
47
fluorobenzeneFc1ccccc1ZINC0000009677595.9Morton et al., 1995
48
hexafluorobenzeneFc1c(c(c(c(c1F)F)F)F)FZINC0000015837431.5Morton et al., 1995
49
indeneC1C=Cc2ccccc21ZINC0000016998881.2193.4183LMorton et al., 1995
50
indolec2cc1ccccc1[nH]2ZINC0000145169841.7289.9185LMorton et al., 1995
51
iodobenzeneIc1ccccc1ZINC0000016998782.6Morton et al., 1995
52
iodoethaneCCIZINC0000139509141.6Morton et al., 1995
53
isobutylbenzeneCC(C)Cc1ccccc1ZINC0000016153272.919.3184LMorton et al., 1995
54
m-xyleneCc1cccc(c1)CZINC0000009682811.8363.6Morton et al., 1995
55
methylcyclohexaneCC1CCCCC1ZINC0000016999641.1Morton et al., 1995
56
n-butylbenzeneCCCCc1ccccc1ZINC0000015867561.4144W57,186LMerski et al., 2014
Morton et al., 1995
57
n-hexylbenzeneCCCCCCc1ccccc1ZINC0000017608230.54W59Merski et al., 2014
Morton et al., 1995
58
n-methylanilineCNc1ccccc1ZINC00000090134313502OTZMobley et al., 2007
59
n-pentylbenzeneCCCCCc1ccccc1ZINC0000016994444W58Merski et al., 2014
Morton et al., 1995
60
n-propylbenzeneCCCc1ccccc1ZINC0000017478376.2184W55Merski et al., 2014
Morton et al., 1995
61
naphthalenec2ccc1ccccc1c2ZINC0000009675221Morton et al., 1995
62
nitrobenzeneO=[N+]([O-])c1ccccc1 ZINC0000008964260.7Morton et al., 1995
63
o-xyleneCc1ccccc1CZINC0000009682822.9469.6188LMorton et al., 1995
64
p-xyleneCc1ccc(cc1)CZINC0000009682542.4421.9187LMorton et al., 1995
65
phenylacetyleneC#Cc1ccccc1ZINC0000016806390.7Morton et al., 1995
66
sec-butylbenzeneCCC(C)c1ccccc1ZINC0000020410001.34W56Merski et al., 2014
Morton et al., 1995
67
styreneC=Cc1ccccc1ZINC0000009682692Morton et al., 1995
68
thianaphthenec2cc1ccccc1s2ZINC0000016791611.5Morton et al., 1995
69
thioanisoleCSc1ccccc1ZINC0000016887631.4Morton et al., 1995
70
thiophene-2-thiolSc1cccs1ZINC0000021691562.1Su et al., 2001
71
thiophenolSc1ccccc1ZINC0000018671274.5Su et al., 2001
72
tolueneCc1ccccc1ZINC0000009675344.41024W53Merski et al., 2014
Morton et al., 1995
73
74
75
76
77
L99A non-binders
78
We have NOT been able to detect binding of these compounds to T4 lysozyme L99A at high concentrations, and we consider them non-binders.
79
80
namesmileszinciddTM (cels)kdpdbref
81
thieno[2,3-c]pyridinec1cc2ccncc2s1ZINC966806-0.4Mobley et al., 2007
82
trichloromethaneClC(Cl)ClZINC8214524Morton et al., 1995
83
methanolCON.A.Morton et al., 1995
84
2-bromoethan-1-olOCCBrZINC4978447Morton et al., 1995
85
2-iodoethan-1-olOCCIZINC13951488Morton et al., 1995
86
ethanolCCOZINC12358605Morton et al., 1995
87
methanesulfinylmethaneCS(C)=OZINC5224188Morton et al., 1995
88
propan-1-olCCCOZINC895969Morton et al., 1995
89
furanO1C=CC=C1ZINC2041074Morton et al., 1995
90
2-methylpropaneCC(C)CZINC8214586Morton et al., 1995
91
pyridineC1=CC=NC=C1ZINC895354Morton et al., 1995
92
1,1-diethylureaCCN(CC)C(N)=OZINC409175Morton et al., 1995
93
1-azido-2,3,4,5,6-pentafluorobenzene
FC1=C(F)C(F)=C(N=[N+]=[N-])C(F)=C1F
ZINC13950912Morton et al., 1995
94
pentafluoroaniline
NC1=C(F)C(F)=C(F)C(F)=C1F
ZINC2022414Morton et al., 1995
95
2-azido-1,3-difluorobenzene
FC1=CC=CC(F)=C1N=[N+]=[N-]
ZINC35854893Morton et al., 1995
96
1,2-diiodobenzeneIC1=C(I)C=CC=C1ZINC6827585Morton et al., 1995
97
1,4-diiodobenzeneIC1=CC=C(I)C=C1ZINC6827587Morton et al., 1995
98
phenolOC1=CC=CC=C1ZINC5133329Morton et al., 1995
99
anilineNC1=CC=CC=C1ZINC17886255Morton et al., 1995
100
2,5-dimethylfuranCC1=CC=C(C)O1ZINC1693339Morton et al., 1995
Loading...
Main menu