1
|
2G5L
|
- |
FME ASP VAL GLU ALA TRP LEU
|
n/a
|
n/a
|
2
|
3WZO
|
- |
ZOE
|
C16 H27 N3 O5 S
|
C1[C@H]2[C....
|
3
|
2RTM
|
- |
IMI
|
C10 H17 N3 O2 S
|
C1[C@H]2[C....
|
4
|
4Y59
|
Kd
=
5.8
uM |
T21
|
C14 H8 F3 N O2
|
c1cc(cc(c1....
|
5
|
1NQM
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
6
|
1VWQ
|
- |
HIS PRO GLN GLY PRO PRO CYS LYS NH2 LEA
|
n/a
|
n/a
|
7
|
1NC9
|
- |
IMI
|
C10 H17 N3 O2 S
|
C1[C@H]2[C....
|
8
|
2RTI
|
- |
GLL
|
C4 H6 N4 O2
|
C12C(NC(=O....
|
9
|
5B5G
|
Kd
=
5.6
uM |
6FX
|
C14 H10 N2 O4
|
COC(=O)c1c....
|
10
|
4Y5D
|
Kd
=
1.2
uM |
MT6
|
C15 H11 N O4
|
COC(=O)c1c....
|
11
|
1SRJ
|
- |
NAB
|
C17 H12 N2 O3
|
c1ccc2c(c1....
|
12
|
4CPF
|
- |
LH3
|
C32 H34 N4 O6 S
|
COC(=O)c1c....
|
13
|
1NDJ
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
14
|
2IZL
|
Kd
=
1
uM |
IMI
|
C10 H17 N3 O2 S
|
C1[C@H]2[C....
|
15
|
2RTJ
|
- |
GLL
|
C4 H6 N4 O2
|
C12C(NC(=O....
|
16
|
1SWR
|
Kd
=
0.12
uM |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
17
|
1SWE
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
18
|
1SRF
|
- |
MTB
|
C17 H18 N2 O3
|
CC(C)(C)c1....
|
19
|
1SLE
|
Kd
=
670
nM |
ACE CYS HIS PRO GLN GLY PRO PRO CYS NH2
|
n/a
|
n/a
|
20
|
4CPE
|
- |
LUV
|
C31 H34 N4 O3 S
|
c1ccc(cc1)....
|
21
|
2RTE
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
22
|
3WZP
|
- |
ZOF
|
C16 H28 N4 O3 S
|
[H]/N=C/1N....
|
23
|
1VWF
|
Kd
=
2200
nM |
ACE CYS HIS PRO GLN GLY PRO PRO CYS NH2
|
n/a
|
n/a
|
24
|
2RTO
|
- |
IMI
|
C10 H17 N3 O2 S
|
C1[C@H]2[C....
|
25
|
1SWT
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
26
|
1SWP
|
Ka
=
100000000
M^-1 |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
27
|
1VWG
|
- |
ACE CYS HIS PRO GLN GLY PRO PRO CYS NH2
|
n/a
|
n/a
|
28
|
6M9B
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
29
|
2RTF
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
30
|
1VWC
|
- |
ACE CYS HIS PRO GLN PHE CYS NH2
|
n/a
|
n/a
|
31
|
1STS
|
Kd
=
10
uM |
PHE CYS HIS PRO GLN ASN THR NH2
|
n/a
|
n/a
|
32
|
2IZI
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
33
|
1VWN
|
Kd
=
1500
nM |
ACE CYS HIS PRO GLN PHE CYS NH2
|
n/a
|
n/a
|
34
|
2IZF
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
35
|
1SWD
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
36
|
1LCW
|
- |
SHM
|
C11 H18 N2 O3 S
|
C1[C@H]2[C....
|
37
|
1RXK
|
- |
BNI
|
C16 H20 N4 O4 S
|
c1cc(ccc1N....
|
38
|
1SRG
|
Ka
=
200000
M^-1 |
MHB
|
C14 H12 N2 O3
|
Cc1cc(ccc1....
|
39
|
1I9H
|
- |
BNI
|
C16 H20 N4 O4 S
|
c1cc(ccc1N....
|
40
|
1VWR
|
- |
HIS PRO GLN GLY PRO PRO CYS LYS NH2 LEA
|
n/a
|
n/a
|
41
|
2IZH
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
42
|
2RTP
|
- |
IMI
|
C10 H17 N3 O2 S
|
C1[C@H]2[C....
|
43
|
1SLD
|
Kd
=
270
nM |
ACE CYS HIS PRO GLN PHE CYS NH2
|
n/a
|
n/a
|
44
|
1KL3
|
Kd
=
1.37
uM |
ASN TRP SER HIS PRO GLN PHE GLU LYS
|
n/a
|
n/a
|
45
|
1DF8
|
Kd
=
0.2
nM |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
46
|
3T6F
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
47
|
1VWO
|
- |
ACE CYS HIS PRO GLN GLY PRO PRO CYS NH2
|
n/a
|
n/a
|
48
|
1VWK
|
- |
HIS PRO GLN GLY PRO PRO CYS LYS NH2 LEA
|
n/a
|
n/a
|
49
|
1SLG
|
Kd
=
125
uM |
PHE SER HIS PRO GLN ASN THR
|
n/a
|
n/a
|
50
|
2RTQ
|
- |
IMI
|
C10 H17 N3 O2 S
|
C1[C@H]2[C....
|
51
|
1N43
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
52
|
3WZN
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
53
|
1VWD
|
- |
ACE CYS HIS PRO GLN PHE CYS NH2
|
n/a
|
n/a
|
54
|
2Y3F
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
55
|
1VWL
|
Kd
=
2.33
uM |
HIS PRO GLN GLY PRO PRO CYS LYS NH2 LEA
|
n/a
|
n/a
|
56
|
1VWA
|
- |
PHE SER HIS PRO GLN ASN THR
|
n/a
|
n/a
|
57
|
2IZG
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
58
|
3MG5
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
59
|
1SRI
|
Ka
=
1200000
M^-1 |
DMB
|
C15 H14 N2 O3
|
Cc1cc(cc(c....
|
60
|
1KL5
|
Kd
=
1.02
uM |
ASN TRP SER HIS PRO GLN PHE GLU LYS
|
n/a
|
n/a
|
61
|
1VWH
|
- |
ACE CYS HIS PRO GLN GLY PRO PRO CYS NH2
|
n/a
|
n/a
|
62
|
1PTS
|
- |
PHE SER HIS PRO GLN ASN THR
|
n/a
|
n/a
|
63
|
1MK5
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
64
|
1LUQ
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
65
|
1VWB
|
- |
ACE CYS HIS PRO GLN PHE CYS NH2
|
n/a
|
n/a
|
66
|
2IZK
|
- |
GLL
|
C4 H6 N4 O2
|
C12C(NC(=O....
|
67
|
1VWE
|
- |
ACE CYS HIS PRO GLN PHE CYS NH2
|
n/a
|
n/a
|
68
|
2RTN
|
- |
IMI
|
C10 H17 N3 O2 S
|
C1[C@H]2[C....
|
69
|
1MEP
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
70
|
3WYP
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
71
|
2RTL
|
- |
IMI
|
C10 H17 N3 O2 S
|
C1[C@H]2[C....
|
72
|
1N9M
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
73
|
1VWI
|
- |
HIS PRO GLN GLY PRO PRO CYS LYS NH2 LEA
|
n/a
|
n/a
|
74
|
2IZJ
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
75
|
1STR
|
Kd
=
17
uM |
ACE CYS HIS PRO GLN ASN THR NH2
|
n/a
|
n/a
|
76
|
1VWP
|
- |
ACE CYS HIS PRO GLN GLY PRO PRO CYS NH2
|
n/a
|
n/a
|
77
|
1VWJ
|
- |
HIS PRO GLN GLY PRO PRO CYS LYS NH2 LEA
|
n/a
|
n/a
|
78
|
1LCV
|
- |
SNR
|
C9 H14 N2 O3 S
|
C1[C@H]2[C....
|
79
|
1RSU
|
Kd
=
72
uM |
SER ASN TRP SER HIS PRO GLN PHE GLU LYS
|
n/a
|
n/a
|
80
|
2RTH
|
- |
GLL
|
C4 H6 N4 O2
|
C12C(NC(=O....
|
81
|
5B5F
|
Kd
=
5.6
uM |
6F3
|
C14 H12 N2 O4 S
|
CNS(=O)(=O....
|
82
|
2F01
|
Kd
~
0.1
pM |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
83
|
1VWM
|
- |
ACE CYS HIS PRO GLN PHE CYS NH2
|
n/a
|
n/a
|
84
|
2GH7
|
Kd
~
0.1
pM |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
85
|
4JNJ
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
86
|
2JGS
|
Kd
=
0.000000064
M |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
87
|
3SZJ
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
88
|
3T2W
|
Kd
=
0.000000064
M |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
89
|
3RDQ
|
Kd
=
0.49
nM |
DTB
|
C10 H18 N2 O3
|
C[C@H]1[C@....
|
90
|
3RDO
|
Kd
=
0.14
nM |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
91
|
3RDM
|
Kd
=
0.14
nM |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
92
|
2OF8
|
- |
BNI
|
C16 H20 N4 O4 S
|
c1cc(ccc1N....
|
93
|
2FHL
|
- |
BNI
|
C16 H20 N4 O4 S
|
c1cc(ccc1N....
|
94
|
2OFB
|
- |
BNI
|
C16 H20 N4 O4 S
|
c1cc(ccc1N....
|
95
|
3X00
|
Kd
=
0.83
nM |
ZOF ZOF EDN
|
n/a
|
n/a
|
96
|
2A5C
|
Kd
=
24
uM |
8DA
|
C10 H15 N5 O4
|
C1[C@H]([C....
|
97
|
3VGW
|
Ka
=
200000
M^-1 |
NVZ
|
C12 H18 N2 O4 S
|
CC(=O)N1[C....
|
98
|
1IJ8
|
- |
BNI
|
C16 H20 N4 O4 S
|
c1cc(ccc1N....
|
99
|
3VHI
|
Ka
=
2300000
M^-1 |
VHI
|
C18 H22 N2 O5 S
|
c1ccc(cc1)....
|
100
|
2A8G
|
Kd
=
205
uM |
GNG
|
C10 H13 N5 O4
|
c1nc2c(n1[....
|
101
|
4I60
|
Kd
=
1.87
uM |
B1R
|
C20 H16 N2 O2 Ru S
|
C1[C@H]2[C....
|
102
|
5IRW
|
- |
D9P
|
C26 H26 N2 O2
|
C[C@H]1[C@....
|
103
|
5F2B
|
- |
9RU
|
C31 H41 Cl2 N5 O2 Ru S
|
Cc1cc(c(c(....
|
104
|
4OKA
|
- |
5IR
|
C18 H26 Ir N5 O4 S2
|
c1cc(ccc1N....
|
105
|
6AUL
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
106
|
4GJV
|
- |
0OD
|
C21 H32 Cl3 N3 O2 Rh S
|
CC12=C3([R....
|
107
|
6ESU
|
Ki
=
249.3
mM |
6IR
|
C18 H27 N5 O4 S2
|
c1cc(ccc1N....
|
108
|
4GJS
|
- |
0OD
|
C21 H32 Cl3 N3 O2 Rh S
|
CC12=C3([R....
|
109
|
2WPU
|
Kd
<
60
nM |
KYT
|
C24 H39 Cl N5 O2 Ru S
|
CC1=[CH]2C....
|
110
|
3PK2
|
- |
4IR
|
C28 H45 Cl Ir N5 O4 S2
|
C[CH]12[CH....
|
111
|
6VJL
|
Kd
=
0.000000064
M |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
112
|
6ESS
|
- |
4IR
|
C28 H45 Cl Ir N5 O4 S2
|
C[CH]12[CH....
|
113
|
2ZSC
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
114
|
3EW2
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
115
|
5N99
|
Kd
=
61.3
uM |
ASN GLN DPR TRP GLN
|
n/a
|
n/a
|
116
|
4GGZ
|
Kd
=
0.066
nM |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
117
|
2UYW
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
118
|
2UZ2
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
119
|
4GDA
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
120
|
1SWG
|
Kd
=
43.9
nM |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
121
|
4GD9
|
- |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
122
|
4BCS
|
Kd
=
103
nM |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|
123
|
4EKV
|
Kd
=
0.000000064
M |
BTN
|
C10 H16 N2 O3 S
|
C1[C@H]2[C....
|