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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 214 families. | |||||
1 | 4QBZ | - | D80 | C14 H15 N3 O | CCCCc1nc2c.... |
2 | 5WYZ | Kd = 21 nM | 7VF | C16 H13 N O2 | Cc1cc(ccc1.... |
3 | 4R07 | Kd = 55 uM | URI | C9 H12 N2 O6 | C1=CN(C(=O.... |
4 | 3W3J | - | C09 | C13 H14 N4 O | CCOCc1[nH].... |
5 | 4QC0 | - | XG1 | C14 H16 N4 | CCCCn1cc2c.... |
6 | 6ZJZ | ic50 = 120 nM | QLH | C16 H15 F3 N4 | c1cc2c(ccc.... |
7 | 3WN4 | - | D87 | C15 H16 N2 O | CCCCc1cc2c.... |
8 | 3W3K | - | L07 | C13 H13 N3 S | CCCc1nc2c(.... |
9 | 5AWB | - | M0A | C22 H25 N5 | CCCCc1nc2c.... |
10 | 4R08 | Kd = 55 uM | URI | C9 H12 N2 O6 | C1=CN(C(=O.... |
11 | 3W3L | - | RX8 | C17 H22 N4 O2 | CCOCc1nc2c.... |
12 | 5WYX | Kd = 0.22 uM | CU8 | C14 H12 N4 O | Cc1cccc(c1.... |
13 | 3W3N | - | RX8 | C17 H22 N4 O2 | CCOCc1nc2c.... |
14 | 4R0A | Kd = 55 uM | URI | C9 H12 N2 O6 | C1=CN(C(=O.... |
15 | 5AWD | - | IDQ | C22 H25 N5 | CCCCc1nc2c.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 181 families. | |||||
1 | 4QBZ | - | D80 | C14 H15 N3 O | CCCCc1nc2c.... |
2 | 5WYZ | Kd = 21 nM | 7VF | C16 H13 N O2 | Cc1cc(ccc1.... |
3 | 4R07 | Kd = 55 uM | URI | C9 H12 N2 O6 | C1=CN(C(=O.... |
4 | 3W3J | - | C09 | C13 H14 N4 O | CCOCc1[nH].... |
5 | 4QC0 | - | XG1 | C14 H16 N4 | CCCCn1cc2c.... |
6 | 6ZJZ | ic50 = 120 nM | QLH | C16 H15 F3 N4 | c1cc2c(ccc.... |
7 | 3WN4 | - | D87 | C15 H16 N2 O | CCCCc1cc2c.... |
8 | 3W3K | - | L07 | C13 H13 N3 S | CCCc1nc2c(.... |
9 | 5AWB | - | M0A | C22 H25 N5 | CCCCc1nc2c.... |
10 | 4R08 | Kd = 55 uM | URI | C9 H12 N2 O6 | C1=CN(C(=O.... |
11 | 3W3L | - | RX8 | C17 H22 N4 O2 | CCOCc1nc2c.... |
12 | 5WYX | Kd = 0.22 uM | CU8 | C14 H12 N4 O | Cc1cccc(c1.... |
13 | 3W3N | - | RX8 | C17 H22 N4 O2 | CCOCc1nc2c.... |
14 | 4R0A | Kd = 55 uM | URI | C9 H12 N2 O6 | C1=CN(C(=O.... |
15 | 5AWD | - | IDQ | C22 H25 N5 | CCCCc1nc2c.... |
16 | 5GMF | Kd = 1 uM | GMP | C10 H13 N5 O5 | c1nc2c(n1[.... |
17 | 5GMH | Kd = 0.49 uM | RX8 | C17 H22 N4 O2 | CCOCc1nc2c.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | XG1 | 0.9996 |
2 | C09 | 0.9914 |
3 | L07 | 0.9604 |
4 | YE7 | 0.9324 |
5 | 2GQ | 0.9288 |
6 | JTF | 0.9266 |
7 | 64F | 0.9238 |
8 | QUB | 0.9234 |
9 | EYA | 0.9227 |
10 | EYM | 0.9217 |
11 | EY7 | 0.9164 |
12 | P83 | 0.9161 |
13 | R4E | 0.9150 |
14 | FSU | 0.9133 |
15 | O82 | 0.9129 |
16 | 5V7 | 0.9108 |
17 | TXW | 0.9093 |
18 | 0SX | 0.9080 |
19 | XJ2 | 0.9080 |
20 | CX4 | 0.9075 |
21 | MN QAY | 0.9044 |
22 | Q5M | 0.9037 |
23 | HA6 | 0.9029 |
24 | MBP | 0.9003 |
25 | ELH | 0.8999 |
26 | 52F | 0.8999 |
27 | 1QP | 0.8995 |
28 | 5NN | 0.8992 |
29 | JYE | 0.8991 |
30 | YM6 | 0.8990 |
31 | 22T | 0.8979 |
32 | BDI | 0.8976 |
33 | 7M2 | 0.8966 |
34 | EY2 | 0.8963 |
35 | ET0 | 0.8961 |
36 | 1CE | 0.8956 |
37 | 9KZ | 0.8948 |
38 | AMR | 0.8937 |
39 | ML1 | 0.8921 |
40 | 3AK | 0.8918 |
41 | 6XC | 0.8914 |
42 | LP8 | 0.8912 |
43 | JWW | 0.8911 |
44 | B61 | 0.8911 |
45 | 9F8 | 0.8909 |
46 | B23 | 0.8904 |
47 | 1X8 | 0.8900 |
48 | ZEZ | 0.8899 |
49 | 28S | 0.8895 |
50 | 5V6 | 0.8894 |
51 | YZ9 | 0.8893 |
52 | CKA | 0.8892 |
53 | UN9 | 0.8886 |
54 | ZEA | 0.8879 |
55 | ETV | 0.8874 |
56 | JY2 | 0.8873 |
57 | XFE | 0.8872 |
58 | X2L | 0.8866 |
59 | WA2 | 0.8863 |
60 | QMS | 0.8862 |
61 | 5V5 | 0.8862 |
62 | 5PK | 0.8853 |
63 | GI2 | 0.8852 |
64 | AC2 | 0.8848 |
65 | 96R | 0.8845 |
66 | 0H5 | 0.8845 |
67 | 7MX | 0.8844 |
68 | DDC | 0.8844 |
69 | LI7 | 0.8844 |
70 | DXK | 0.8842 |
71 | 30G | 0.8832 |
72 | II4 | 0.8832 |
73 | X0T | 0.8830 |
74 | ZIP | 0.8826 |
75 | 2T4 | 0.8822 |
76 | 7L4 | 0.8817 |
77 | 78P | 0.8813 |
78 | 5SJ | 0.8812 |
79 | 7PJ | 0.8812 |
80 | 34L | 0.8812 |
81 | 5UH | 0.8807 |
82 | 6U5 | 0.8805 |
83 | RKY | 0.8801 |
84 | HDU | 0.8799 |
85 | 0HY | 0.8797 |
86 | 3GX | 0.8796 |
87 | Z25 | 0.8794 |
88 | 1Q4 | 0.8791 |
89 | 74Z | 0.8787 |
90 | 55D | 0.8774 |
91 | B4L | 0.8773 |
92 | 3WK | 0.8771 |
93 | A4G | 0.8766 |
94 | 2LW | 0.8766 |
95 | YE6 | 0.8764 |
96 | 0FR | 0.8762 |
97 | 67Y | 0.8761 |
98 | JPS | 0.8759 |
99 | M1D | 0.8758 |
100 | NEO | 0.8751 |
101 | 5ER | 0.8750 |
102 | 5WS | 0.8749 |
103 | 0RY | 0.8748 |
104 | F91 | 0.8747 |
105 | O83 | 0.8743 |
106 | HWH | 0.8743 |
107 | RNP | 0.8741 |
108 | C9E | 0.8741 |
109 | C8O | 0.8734 |
110 | GI1 | 0.8733 |
111 | TCR | 0.8732 |
112 | ASE | 0.8730 |
113 | SNB | 0.8726 |
114 | 6JO | 0.8725 |
115 | GI4 | 0.8721 |
116 | 018 | 0.8718 |
117 | 5TQ | 0.8716 |
118 | KOM | 0.8713 |
119 | 6VD | 0.8706 |
120 | QS4 | 0.8705 |
121 | WG8 | 0.8703 |
122 | UAY | 0.8702 |
123 | C4E | 0.8701 |
124 | SJK | 0.8700 |
125 | IOP | 0.8700 |
126 | JTA | 0.8695 |
127 | UNM | 0.8694 |
128 | 8RK | 0.8692 |
129 | GNJ | 0.8690 |
130 | 020 | 0.8686 |
131 | IQU | 0.8682 |
132 | GNV | 0.8679 |
133 | JHY | 0.8676 |
134 | ZYV | 0.8672 |
135 | RVE | 0.8670 |
136 | LDR | 0.8670 |
137 | GNG | 0.8662 |
138 | UXH | 0.8662 |
139 | 8HG | 0.8660 |
140 | FC2 | 0.8658 |
141 | NIP | 0.8658 |
142 | 7VF | 0.8658 |
143 | H7S | 0.8656 |
144 | 092 | 0.8654 |
145 | NEU | 0.8650 |
146 | 9AP | 0.8648 |
147 | NPL | 0.8644 |
148 | 1AJ | 0.8641 |
149 | 0J2 | 0.8633 |
150 | BB4 | 0.8630 |
151 | JVD | 0.8628 |
152 | GZV | 0.8627 |
153 | MUX | 0.8625 |
154 | QTS | 0.8625 |
155 | 96Z | 0.8624 |
156 | 5WN | 0.8622 |
157 | 8GK | 0.8619 |
158 | 4VT | 0.8605 |
159 | 35K | 0.8605 |
160 | S0I | 0.8604 |
161 | D2G | 0.8604 |
162 | EBB | 0.8597 |
163 | K6B | 0.8596 |
164 | WUL | 0.8595 |
165 | PMM | 0.8593 |
166 | LWS | 0.8592 |
167 | A0O | 0.8590 |
168 | CKI | 0.8589 |
169 | 8Y7 | 0.8588 |
170 | BK9 | 0.8588 |
171 | KMG | 0.8586 |
172 | 9BF | 0.8579 |
173 | SRO | 0.8574 |
174 | IKY | 0.8574 |
175 | M02 | 0.8570 |
176 | KYA | 0.8563 |
177 | G30 | 0.8555 |
178 | 6PB | 0.8545 |
179 | OAL | 0.8544 |
180 | D5F | 0.8540 |
181 | VJJ | 0.8537 |
182 | 2QU | 0.8536 |
183 | F95 | 0.8533 |
184 | CKU | 0.8532 |
185 | SYE | 0.8530 |
186 | M01 | 0.8523 |
187 | NNR | 0.8518 |
This union binding pocket(no: 1) in the query (biounit: 5wyz.bio1) has 86 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 5wyz.bio1) has 86 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |