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- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 101 families. | |||||
1 | 4FBX | - | 0TJ GLY ASP ASP ASP ASP ASP | n/a | n/a |
2 | 6L21 | - | E3U | C16 H12 O6 | c1cc(c(c2c.... |
3 | 5OUU | - | AWN | C22 H20 Cl N3 | c1ccc(cc1).... |
4 | 4RLL | - | E91 | C21 H14 N2 O2 | c1ccc2c(c1.... |
5 | 5CU4 | Kd = 0.32 uM | 54S | C26 H26 Cl N3 O4 | c1ccc(cc1).... |
6 | 6HOT | - | CIY | C10 H10 O3 | COc1cc(ccc.... |
7 | 5ORJ | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
8 | 3MB6 | ic50 = 100 nM | 01I | C16 H8 O6 | c1cc2c(cc(.... |
9 | 5M4F | - | 7FC | C16 H8 Cl2 O5 | c1cc(ccc1C.... |
10 | 6A1C | - | 9NX | C17 H15 Br N4 O2 S | COc1cc(c(c.... |
11 | 6EHU | - | B5E | C25 H24 F3 N3 | CCc1ccccc1.... |
12 | 5CVH | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
13 | 3BQC | ic50 ~ 2 uM | EMO | C15 H10 O5 | Cc1cc2c(c(.... |
14 | 6L22 | - | E3U | C16 H12 O6 | c1cc(c(c2c.... |
15 | 5N9K | Ki = 0.46 nM | 8QK | C20 H13 Cl2 N O4 | COc1ccc(cc.... |
16 | 5OTQ | - | AUH | C25 H27 N3 O | CCc1ccccc1.... |
17 | 5CU2 | - | 54G | C8 H8 O3 | Cc1ccc(c(c.... |
18 | 5MO5 | - | 4IH | C17 H21 Cl N2 O2 S | CS(=O)(=O).... |
19 | 5M4I | - | 7FC | C16 H8 Cl2 O5 | c1cc(ccc1C.... |
20 | 5MP8 | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
21 | 6HOR | - | GJK | C11 H12 O3 | CC(=O)/C=C.... |
22 | 5MOV | - | HC4 | C9 H8 O3 | c1cc(ccc1C.... |
23 | 5MOH | - | YTX | C9 H10 O4 | COc1cc(ccc.... |
24 | 6JWA | ic50 = 10.9 uM | 5ID | C11 H13 I N4 O4 | c1c(c2c(nc.... |
25 | 6HNW | ic50 = 200 nM | CUE | C15 H8 O5 | c1cc2c(cc1.... |
26 | 5CSH | Kd = 270 uM | 54E | C13 H12 Cl N | c1ccc(cc1).... |
27 | 7A49 | ic50 = 3.26 uM | QWN | C5 H2 Br Cl N4 | c1c2c(nc(c.... |
28 | 5OTL | - | AQT | C25 H26 Cl N3 O | CCc1ccccc1.... |
29 | 5ORK | Kd = 234 uM | A4T | C13 H11 Cl F N | c1ccc(c(c1.... |
30 | 7A4B | ic50 = 2.56 uM | QXW | C5 H2 Br2 N4 | c1c2c(nc(c.... |
31 | 3OWL | ic50 = 0.67 uM | 19E | C16 H11 Cl N2 O | Cc1cnc(c2c.... |
32 | 5OYF | - | B4Q | C25 H27 N3 | CCc1ccccc1.... |
33 | 5H8G | Kd = 48.2 pM | 5Y4 | C23 H29 N9 O | CC(=O)Nc1c.... |
34 | 5OS7 | - | A8Q | C16 H19 Cl N | CC(C)c1ccc.... |
35 | 6YPJ | - | P5W | C16 H12 N2 O2 S | c1ccc(cc1).... |
36 | 5OTZ | Kd = 6.5 uM | AUT | C15 H15 Cl2 N | CCc1ccccc1.... |
37 | 6HOQ | - | FER | C10 H10 O4 | COc1cc(ccc.... |
38 | 5OUM | - | AVK | C18 H18 Cl N3 | c1ccc(cc1).... |
39 | 5B0X | ic50 = 0.02 uM | HCK | C18 H14 N2 O4 S | COc1ccc(cc.... |
40 | 5MO8 | Kd = 1.64 uM | C98 | C26 H26 Cl N3 O4 | c1ccc(cc1).... |
41 | 6RCB | ic50 = 0.33 uM | JYZ | C17 H14 N2 O4 | COc1cc(ccc.... |
42 | 6HME | - | FXB | C21 H21 N O3 | CC(C)n1c2c.... |
43 | 6HOP | - | FER | C10 H10 O4 | COc1cc(ccc.... |
44 | 5OTO | - | AQW | C24 H23 Cl2 N3 | CCc1ccccc1.... |
45 | 3AT4 | Kd = 2.26 nM | CCK | C20 H20 N6 O2 | CC(C)Nc1cc.... |
46 | 3OWJ | Ki = 0.86 uM | 1EL | C17 H14 N2 O2 | Cc1c2c(c(c.... |
47 | 6RFF | ic50 = 0.37 uM | K1B | C12 H6 Br N5 O4 S | c1cc(c(cc1.... |
48 | 6EII | - | B5W | C22 H23 Cl N | c1ccc(cc1).... |
49 | 5CU0 | - | 54R | C18 H21 Cl N2 O | CC(=O)NCCC.... |
50 | 5H8E | Kd = 6.33 pM | 5Y3 | C21 H25 N9 O | CC(=O)Nc1c.... |
51 | 5OWH | - | B0K | C10 H9 Br4 N3 | c1nc2c(n1C.... |
52 | 6L1Z | - | E3U | C16 H12 O6 | c1cc(c(c2c.... |
53 | 3WAR | - | NIO | C6 H5 N O2 | c1cc(cnc1).... |
54 | 5MOE | Kd = 520 uM | OQC | C11 H10 Cl N O | c1cc(c(cc1.... |
55 | 5OUE | - | AVZ | C18 H19 Cl N3 | c1ccc(cc1).... |
56 | 5MOD | Kd = 300 uM | 86L | C10 H14 Cl N O | CC(C)Oc1cc.... |
57 | 6RB1 | ic50 = 1.37 uM | JWQ | C14 H9 F3 N4 O3 S | COc1cc(ccc.... |
58 | 6TEI | - | N4N | C15 H11 N3 O2 S | c1ccnc(c1).... |
59 | 5OWL | - | B0K | C10 H9 Br4 N3 | c1nc2c(n1C.... |
60 | 6HBN | - | FXB | C21 H21 N O3 | CC(C)n1c2c.... |
61 | 5CU3 | Kd = 0.32 uM | 54S | C26 H26 Cl N3 O4 | c1ccc(cc1).... |
62 | 5OTR | - | AU8 | C13 H12 Cl2 N | c1ccc(cc1).... |
63 | 4KWP | Ki = 0.04 uM | EXX | C12 H10 Br4 N2 O3 | c1nc2c(n1[.... |
64 | 5OSL | - | A9K | C13 H12 Cl N O | c1ccc(c(c1.... |
65 | 5N9N | Ki = 0.41 nM | KC5 | C20 H15 Cl2 N O4 | COc1ccc(cc.... |
66 | 5CSP | Kd = 58 uM | 54G | C8 H8 O3 | Cc1ccc(c(c.... |
67 | 5CTP | - | 54R | C18 H21 Cl N2 O | CC(=O)NCCC.... |
68 | 5MOW | - | BR9 | C5 H6 Br N3 | c1c(cnc(c1.... |
69 | 4UB7 | Ki = 2.5 nM | 3G5 | C16 H8 Br2 O5 | c1cc(ccc1C.... |
70 | 5MMF | - | JMB | C16 H19 Cl N | CCC[NH2+]C.... |
71 | 5OTH | - | AQ8 | C25 H26 Cl N3 O | CCc1ccccc1.... |
72 | 1PJK | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
73 | 6YPK | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
74 | 3NSZ | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
75 | 5OTI | - | AOK | C25 H26 Cl N3 | CCc1ccccc1.... |
76 | 3AXW | - | TID | C9 H7 N3 O2 S | c1cc(ccc1c.... |
77 | 5MO6 | - | KXZ | C19 H21 Cl N2 O3 | c1ccc(cc1).... |
78 | 2PVR | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
79 | 3C13 | - | EMO | C15 H10 O5 | Cc1cc2c(c(.... |
80 | 5CS6 | Kd = 630 uM | K82 | C10 H14 Cl N O | CCCOc1ccc(.... |
81 | 6YPH | - | N5Q | C20 H14 N2 O3 S | c1ccc2cc(c.... |
82 | 3PE2 | Ki = 0.175 nM | E1B | C20 H12 N4 O2 | C#Cc1cccc(.... |
83 | 5CT0 | - | 54P | C16 H18 Cl N O | c1ccc(cc1).... |
84 | 6RCM | ic50 = 0.36 uM | K0N | C17 H18 N4 O3 S | CC(C)(C)c1.... |
85 | 5CU6 | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
86 | 5M4C | - | 7EY | C16 H14 N2 O2 S2 | Cc1ccc(cc1.... |
87 | 6SPX | ic50 = 44 uM | DAS ASP ASP ASP ASP ASP LYS 9AB | n/a | n/a |
88 | 5MO7 | - | YRA | C16 H17 Cl N2 O | c1ccc(cc1).... |
89 | 5N9L | Ki = 15 nM | 8QH | C20 H15 Cl2 N O3 | Cc1ccc(cc1.... |
90 | 5OT5 | - | AWK | C25 H26 Cl N3 | CCc1ccccc1.... |
91 | 3OWK | ic50 = 1.5 uM | 18E | C16 H11 Cl N2 O | Cc1cnc(c2c.... |
92 | 5MMR | - | H83 | C17 H21 Cl N2 | c1ccc(cc1).... |
93 | 5MPJ | - | J2P | C15 H17 Cl N | CC[NH2+]Cc.... |
94 | 5OQU | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
95 | 6GIH | - | EZN | C15 H13 Cl N2 | c1cc(c2cc[.... |
96 | 6RFE | ic50 = 0.28 uM | K0Z | C13 H9 Br N4 O3 S | COc1cc(ccc.... |
97 | 6YPG | - | N5Q | C20 H14 N2 O3 S | c1ccc2cc(c.... |
98 | 5CSV | - | GAB | C7 H7 N O2 | c1cc(cc(c1.... |
99 | 5MOT | - | HBD | C7 H7 N O2 | c1cc(ccc1C.... |
100 | 3R0T | ic50 = 0.91 nM | FU9 | C22 H16 F3 N5 O2 | c1cc(cc(c1.... |
101 | 3PE1 | Ki = 0.223 nM | 3NG | C19 H12 Cl N3 O2 | c1cc(cc(c1.... |
102 | 3JUH | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
103 | 5CLP | - | 42J | C8 H9 Cl2 N | c1cc(c(cc1.... |
104 | 5ORH | Kd = 41 uM | A4N | C14 H14 Cl N | Cc1ccccc1c.... |
105 | 3H30 | Ki = 29.2 uM | RFZ | C12 H12 Cl2 N2 O4 | c1c2c(cc(c.... |
106 | 2ZJW | Ki = 0.02 uM | REF | C14 H6 O8 | c1c2c-3c(c.... |
107 | 6HOU | - | V55 | C8 H8 O3 | COc1cc(ccc.... |
108 | 7A4C | ic50 = 3.82 uM | QWW | C5 H Br3 N4 | c12c(c(c(n.... |
109 | 6YPN | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
110 | 5OSZ | - | AHK | C24 H25 Cl N3 | CCc1ccccc1.... |
111 | 4GRB | ic50 = 17 nM | 0XG | C19 H18 N4 O4 S | CN(C)C(=O).... |
112 | 5OT6 | - | AJK | C19 H20 Cl N2 | c1ccc(cc1).... |
113 | 6EHK | - | AUW | C24 H23 Cl2 N3 | CCc1ccccc1.... |
114 | 6L24 | - | E3U | C16 H12 O6 | c1cc(c(c2c.... |
115 | 3MB7 | ic50 = 200 nM | 14I | C16 H8 O6 | c1cc2c(cc(.... |
116 | 5OS8 | - | J27 | C14 H14 Cl F N | Cc1cc(ccc1.... |
117 | 5OTY | - | AUW | C24 H23 Cl2 N3 | CCc1ccccc1.... |
118 | 5OTD | - | AOW | C24 H24 Cl N4 O2 | CCc1ccccc1.... |
119 | 6GMD | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
120 | 5CVF | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
121 | 6HNY | - | GHT | C19 H19 N O4 | CN1CCc2cc(.... |
122 | 5CX9 | - | 551 | C20 H23 Cl N2 O3 | COC(=O)CC(.... |
123 | 5OUL | - | AWE | C13 H11 Cl F N | c1cc(cc(c1.... |
124 | 6TEW | - | N5Q | C20 H14 N2 O3 S | c1ccc2cc(c.... |
125 | 5Y9M | - | NIO | C6 H5 N O2 | c1cc(cnc1).... |
126 | 7A1B | ic50 = 2.36 uM | QXW | C5 H2 Br2 N4 | c1c2c(nc(c.... |
127 | 7A2H | - | QX2 | C6 H2 Br3 N3 | c1[nH]c2c(.... |
128 | 5M56 | - | 7FC | C16 H8 Cl2 O5 | c1cc(ccc1C.... |
129 | 5M4U | - | 7FC | C16 H8 Cl2 O5 | c1cc(ccc1C.... |
130 | 6HMD | - | GDW | C21 H24 N2 O2 | CCN(CC)CCn.... |
131 | 6HMQ | - | 4B0 | C9 H7 Br4 N3 O | C(Cn1c2c(c.... |
132 | 5OOI | - | 9YE | C23 H25 N O3 | CC(C)n1c2c.... |
133 | 7A1Z | ic50 = 3.38 uM | QWN | C5 H2 Br Cl N4 | c1c2c(nc(c.... |
134 | 6TE2 | - | N4N | C15 H11 N3 O2 S | c1ccnc(c1).... |
135 | 6HMB | - | 3NG | C19 H12 Cl N3 O2 | c1cc(cc(c1.... |
136 | 7A22 | ic50 = 1.98 uM | QWW | C5 H Br3 N4 | c12c(c(c(n.... |
137 | 3OFM | - | 4B0 | C9 H7 Br4 N3 O | C(Cn1c2c(c.... |
138 | 6HMC | - | FXB | C21 H21 N O3 | CC(C)n1c2c.... |
139 | 5YF9 | - | NIO | C6 H5 N O2 | c1cc(cnc1).... |
140 | 6TGU | - | N92 | C16 H11 Cl N2 O3 S | c1cc(ccc1c.... |
141 | 2PVH | Ki = 0.26 uM | P19 | C17 H14 N6 | c1ccc(cc1).... |
142 | 1M2P | - | HNA | C14 H7 N O6 | c1cc2c(c(c.... |
143 | 1LPU | - | BEN | C7 H8 N2 | [H]/N=C(c1.... |
144 | 2QC6 | ic50 = 0.1 uM | G12 | C10 H6 Br2 O3 | CC1=C(C(=O.... |
145 | 4ANM | ic50 = 28 nM | WUL | C15 H14 Br N3 O3 | c1cc2c(cc1.... |
146 | 1DAW | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
147 | 4RLK | - | E91 | C21 H14 N2 O2 | c1ccc2c(c1.... |
148 | 2OXD | - | K32 | C7 H2 Br4 N2 O | c12c(c(c(c.... |
149 | 2PVM | Ki = 0.36 uM | P29 | C17 H15 N9 | c1ccc(cc1).... |
150 | 1J91 | - | TBS | C6 H Br4 N3 | c12c(c(c(c.... |
151 | 3FL5 | - | TXQ | C14 H8 O6 | c1cc(c(c2c.... |
152 | 3PWD | Ki = 0.22 uM | CZ0 | C14 H9 N O5 | CC1=CC(=O).... |
153 | 3KXH | - | K66 | C11 H9 Br4 N3 O2 | CN(C)c1nc2.... |
154 | 4DGM | ic50 = 1.2 uM | AGI | C15 H10 O5 | c1cc(ccc1C.... |
155 | 3PVG | - | K68 | C9 H4 Br4 N2 O2 | c1nc2c(n1C.... |
156 | 1ZOG | Ki = 0.07 uM | K37 | C8 H4 Br4 N2 S | CSc1[nH]c2.... |
157 | 2PVJ | Ki = 0.005 uM | P44 | C19 H21 N7 | c1ccc(cc1).... |
158 | 4DGN | ic50 = 0.35 uM | LU2 | C15 H10 O6 | c1cc(c(cc1.... |
159 | 1M2Q | - | MNX | C13 H7 N O6 | c1cc(c2c(c.... |
160 | 2OXY | - | K17 | C7 H2 Br4 N2 | c1[nH]c2c(.... |
161 | 1M2R | - | MNY | C14 H10 N2 O4 | c1cc(c2c(c.... |
162 | 3KXN | - | K8X | C7 H2 I4 N2 | c1[nH]c2c(.... |
163 | 6QS5 | ic50 = 0.57 uM | JGB | C10 H8 N2 O3 | c1cc(c(cc1.... |
164 | 1ZOE | Ki = 0.04 uM | K25 | C9 H7 Br4 N3 | CN(C)c1[nH.... |
165 | 2PVL | Ki = 0.024 uM | P55 | C18 H20 N8 | CCN1CCN(CC.... |
166 | 1LP4 | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
167 | 2PVN | Ki = 0.00035 uM | P63 | C20 H16 N8 O | CC(=O)Nc1c.... |
168 | 3KXG | - | K6X | C7 H Br5 N2 | c12c(c(c(c.... |
169 | 3BE9 | Ki = 24 nM | P04 | C19 H21 N7 O | c1cc2cc(c1.... |
170 | 2OXX | - | K22 | C7 H2 Br4 N2 S | c12c(c(c(c.... |
171 | 3KXM | - | K74 | C11 H9 Br4 N3 O S | CNC(=O)CSc.... |
172 | 1LR4 | - | BEN | C7 H8 N2 | [H]/N=C(c1.... |
173 | 1OM1 | Ki = 0.17 uM | IQA | C17 H12 N2 O3 | c1ccc2c(c1.... |
174 | 1ZOH | Ki = 0.1 uM | K44 | C10 H7 Br4 N3 | C[N@@]1CCn.... |
175 | 2PVK | Ki = 0.008 uM | P45 | C19 H14 Cl N7 | c1ccc(cc1).... |
176 | 1DAY | - | GNP | C10 H17 N6 O13 P3 | c1nc2c(n1[.... |
177 | 6KO6 | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
178 | 6K3L | Kd = 60.1 nM | 3NG | C19 H12 Cl N3 O2 | c1cc(cc(c1.... |
179 | 6ISJ | - | 3NG | C19 H12 Cl N3 O2 | c1cc(cc(c1.... |
180 | 5OMY | - | 9YE | C23 H25 N O3 | CC(C)n1c2c.... |
181 | 6SPW | ic50 = 4.5 uM | DAS ASP ASP ASP ASP ASP LYS A0Z | n/a | n/a |
182 | 5ONI | - | 9YE | C23 H25 N O3 | CC(C)n1c2c.... |
183 | 6XX7 | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 8 families. | |||||
1 | 3PXQ | Kd = 37 uM | 2AN | C16 H13 N O3 S | c1ccc(cc1).... |
2 | 2R3N | ic50 = 70 nM | SCZ | C21 H19 N5 | c1ccc(cc1).... |
3 | 1H0V | - | UN4 | C10 H12 N6 O2 | c1[nH]c2c(.... |
4 | 4NJ3 | Kd = 0.3 uM | 2KD | C27 H21 Cl N2 O6 | COC(=O)[C@.... |
5 | 1JSV | - | U55 | C10 H11 N5 O2 S | c1cc(ccc1N.... |
6 | 1OIQ | ic50 = 2.9 uM | HDU | C14 H13 N5 O | Cc1c(n2ccc.... |
7 | 2W17 | ic50 = 0.002 uM | I19 | C24 H30 F N7 O | Cc1ncc(n1C.... |
8 | 2VTP | ic50 = 0.003 uM | LZ9 | C17 H11 F3 N4 O2 | c1cc(c(c(c.... |
9 | 1JVP | ic50 = 1.6 uM | LIG | C15 H11 N3 | c1ccc-2c(c.... |
10 | 1FVT | - | 106 | C14 H11 Br N4 O3 S | c1cc(ccc1N.... |
11 | 4KD1 | - | 1QK | C21 H29 N6 O2 | CCc1cnn2c1.... |
12 | 3LE6 | ic50 = 0.035 uM | 2BZ | C17 H10 Cl N5 O2 | Cc1c-2nc(c.... |
13 | 2VTI | ic50 = 0.66 uM | LZ3 | C14 H12 N4 O3 S | c1ccc2c(c1.... |
14 | 3LFS | Ki = 2.5 uM | A07 | C17 H16 Cl N3 O | CCCC(=O)Nc.... |
15 | 1PXI | - | CK1 | C8 H5 Cl2 N3 S | c1cnc(nc1c.... |
16 | 4LYN | - | 1YG | C20 H23 N3 O2 S2 | C[C@@H](c1.... |
17 | 1YKR | ic50 = 0.56 uM | 628 | C20 H14 Cl2 N4 O3 S | c1cc(c(c(c.... |
18 | 1PXN | Ki = 0.07 uM | CK6 | C15 H15 N5 O S | Cc1c(sc(n1.... |
19 | 2R3J | ic50 = 10 nM | SCJ | C18 H14 Br N5 | c1ccc(cc1).... |
20 | 6Q3F | - | HEW | C5 H5 Br N2 | c1cnc(cc1B.... |
21 | 3IG7 | ic50 = 9 nM | EFP | C18 H22 N4 O3 | CC(=O)NC1C.... |
22 | 2VTS | ic50 = 0.03 uM | LZC | C16 H23 N7 | CC(C)Nc1cc.... |
23 | 1P2A | ic50 = 12 nM | 5BN | C17 H15 F N4 O | c1cc([nH]c.... |
24 | 2BHE | ic50 = 1 uM | BRY | C16 H9 Br N2 O2 | c1ccc2c(c1.... |
25 | 3UNK | ic50 = 15 uM | 0BY | C17 H13 Cl N4 O2 | c1ccc(c(c1.... |
26 | 2VTQ | ic50 = 0.14 uM | LZA | C16 H17 F2 N5 O2 | c1cc(c(c(c.... |
27 | 2C68 | ic50 = 1.8 uM | CT6 | C18 H15 Br N5 | c1cc(cc(c1.... |
28 | 3TIZ | - | 3TI | C17 H13 N O2 | c1ccc2c(c1.... |
29 | 3PXY | ic50 = 5.9 uM | JWS | C10 H11 N5 O2 | COc1ccc(c(.... |
30 | 2R3M | ic50 = 10 nM | SCX | C19 H17 F2 N7 | CCc1cnn2c1.... |
31 | 6HOT | - | CIY | C10 H10 O3 | COc1cc(ccc.... |
32 | 5ORJ | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
33 | 3MB6 | ic50 = 100 nM | 01I | C16 H8 O6 | c1cc2c(cc(.... |
34 | 5M4F | - | 7FC | C16 H8 Cl2 O5 | c1cc(ccc1C.... |
35 | 6A1C | - | 9NX | C17 H15 Br N4 O2 S | COc1cc(c(c.... |
36 | 6EHU | - | B5E | C25 H24 F3 N3 | CCc1ccccc1.... |
37 | 5CVH | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
38 | 3BQC | ic50 ~ 2 uM | EMO | C15 H10 O5 | Cc1cc2c(c(.... |
39 | 6L22 | - | E3U | C16 H12 O6 | c1cc(c(c2c.... |
40 | 5N9K | Ki = 0.46 nM | 8QK | C20 H13 Cl2 N O4 | COc1ccc(cc.... |
41 | 5OTQ | - | AUH | C25 H27 N3 O | CCc1ccccc1.... |
42 | 5CU2 | - | 54G | C8 H8 O3 | Cc1ccc(c(c.... |
43 | 5MO5 | - | 4IH | C17 H21 Cl N2 O2 S | CS(=O)(=O).... |
44 | 5M4I | - | 7FC | C16 H8 Cl2 O5 | c1cc(ccc1C.... |
45 | 5MP8 | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
46 | 6HOR | - | GJK | C11 H12 O3 | CC(=O)/C=C.... |
47 | 4UZH | ic50 = 9800 nM | JVE | C15 H13 F N4 O | c1ccc(c(c1.... |
48 | 6R49 | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
49 | 6R4A | - | JRT | C17 H17 N3 O | c1ccc(cc1).... |
50 | 5OS1 | Kd = 494 uM | A7H | C10 H11 N O S | CCOc1ccc2c.... |
51 | 2C6E | - | HPM | C28 H31 N7 O4 | COc1cc2c(c.... |
52 | 3H0Y | ic50 = 0.006 uM | 48B | C23 H17 Cl F N5 O2 | c1ccc(c(c1.... |
53 | 4B0G | ic50 = 0.015 uM | VEK | C19 H21 Br N8 O | Cc1cc(no1).... |
54 | 4JBP | ic50 = 41 nM | YPH | C34 H36 N6 O4 | c1ccc(cc1).... |
55 | 3H10 | - | 97B | C30 H25 Cl F2 N6 O | CN1CCN(CC1.... |
56 | 6VPM | - | MLA | C3 H4 O4 | C(C(=O)O)C.... |
57 | 5Y9M | - | NIO | C6 H5 N O2 | c1cc(cnc1).... |
58 | 7A1B | ic50 = 2.36 uM | QXW | C5 H2 Br2 N4 | c1c2c(nc(c.... |
59 | 7A2H | - | QX2 | C6 H2 Br3 N3 | c1[nH]c2c(.... |
60 | 1M2P | - | HNA | C14 H7 N O6 | c1cc2c(c(c.... |
61 | 1LPU | - | BEN | C7 H8 N2 | [H]/N=C(c1.... |
62 | 2QC6 | ic50 = 0.1 uM | G12 | C10 H6 Br2 O3 | CC1=C(C(=O.... |
63 | 4ANM | ic50 = 28 nM | WUL | C15 H14 Br N3 O3 | c1cc2c(cc1.... |
64 | 1DAW | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
65 | 4RLK | - | E91 | C21 H14 N2 O2 | c1ccc2c(c1.... |
66 | 2OXD | - | K32 | C7 H2 Br4 N2 O | c12c(c(c(c.... |
67 | 1JKL | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
68 | 3F5G | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
69 | 5AUZ | ic50 = 98 uM | GEN | C15 H10 O5 | c1cc(ccc1C.... |
70 | 4FG9 | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
71 | 5L2T | - | 6ZZ | C23 H30 N8 O | CN(C)C(=O).... |
72 | 3GC0 | - | AMP | C10 H14 N5 O7 P | c1nc(c2c(n.... |
73 | 3MFU | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
74 | 3C0H | - | AMP | C10 H14 N5 O7 P | c1nc(c2c(n.... |
75 | 3C0I | - | 3AM | C10 H14 N5 O7 P | c1nc(c2c(n.... |
76 | 3MFS | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
77 | 5OMY | - | 9YE | C23 H25 N O3 | CC(C)n1c2c.... |
78 | 2YAB | - | AMP | C10 H14 N5 O7 P | c1nc(c2c(n.... |
79 | 2YAA | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
80 | 4JR7 | - | GNP | C10 H17 N6 O13 P3 | c1nc2c(n1[.... |