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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 271 families. | |||||
1 | 3CIW | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
2 | 4JYE | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
3 | 3CIX | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
4 | 5FEX | - | 5AD SEC | n/a | n/a |
5 | 5FF3 | - | PRS | C4 H7 N O2 S | C1[C@H](NC.... |
6 | 5FEP | - | SAM | C15 H22 N6 O5 S | C[S@@+](CC.... |
7 | 3IIZ | - | SAM | C15 H22 N6 O5 S | C[S@@+](CC.... |
8 | 5FES | - | SAM | C15 H22 N6 O5 S | C[S@@+](CC.... |
9 | 5FF0 | - | 5X8 | C13 H18 N6 O5 S | c1nc(c2c(n.... |
10 | 4JXC | - | SAM | C15 H22 N6 O5 S | C[S@@+](CC.... |
11 | 4JY9 | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
12 | 4JYF | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
13 | 5FF4 | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
14 | 3IIX | - | MET | C5 H11 N O2 S | CSCC[C@@H].... |
15 | 4JYD | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
16 | 5FEW | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
17 | 5FF2 | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
18 | 5FEZ | - | 9SE | C6 H9 N O4 Se | C[C@]1(N[C.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 223 families. | |||||
1 | 3CIW | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
2 | 4JYE | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
3 | 3CIX | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
4 | 5FEX | - | 5AD SEC | n/a | n/a |
5 | 5FF3 | - | PRS | C4 H7 N O2 S | C1[C@H](NC.... |
6 | 5FEP | - | SAM | C15 H22 N6 O5 S | C[S@@+](CC.... |
7 | 3IIZ | - | SAM | C15 H22 N6 O5 S | C[S@@+](CC.... |
8 | 5FES | - | SAM | C15 H22 N6 O5 S | C[S@@+](CC.... |
9 | 5FF0 | - | 5X8 | C13 H18 N6 O5 S | c1nc(c2c(n.... |
10 | 4JXC | - | SAM | C15 H22 N6 O5 S | C[S@@+](CC.... |
11 | 4JY9 | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
12 | 4JYF | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
13 | 5FF4 | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
14 | 3IIX | - | MET | C5 H11 N O2 S | CSCC[C@@H].... |
15 | 4JYD | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
16 | 5FEW | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
17 | 5FF2 | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
18 | 5FEZ | - | 9SE | C6 H9 N O4 Se | C[C@]1(N[C.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 5X8 | 1 | 1 |
2 | SAH | 0.759494 | 0.969697 |
3 | DTA | 0.694444 | 0.855072 |
4 | 3DH | 0.689189 | 0.895522 |
5 | DSH | 0.675325 | 0.885714 |
6 | MTA | 0.64 | 0.895522 |
7 | A7D | 0.634146 | 0.897059 |
8 | ADN | 0.619718 | 0.865672 |
9 | RAB | 0.619718 | 0.865672 |
10 | XYA | 0.619718 | 0.865672 |
11 | SFG | 0.619048 | 0.924242 |
12 | SXZ | 0.606383 | 0.888889 |
13 | SA8 | 0.604651 | 0.887324 |
14 | EEM | 0.602273 | 0.863014 |
15 | SAI | 0.597701 | 0.926471 |
16 | 5CD | 0.594595 | 0.878788 |
17 | S7M | 0.588889 | 0.888889 |
18 | A | 0.5875 | 0.783784 |
19 | AMP | 0.5875 | 0.783784 |
20 | 5N5 | 0.581081 | 0.865672 |
21 | U4Y | 0.578431 | 0.927536 |
22 | A4D | 0.573333 | 0.893939 |
23 | SMM | 0.571429 | 0.853333 |
24 | SSA | 0.571429 | 0.729412 |
25 | S8M | 0.569892 | 0.873239 |
26 | K15 | 0.568421 | 0.851351 |
27 | LMS | 0.567901 | 0.710843 |
28 | M2T | 0.564103 | 0.84507 |
29 | DSZ | 0.56383 | 0.75 |
30 | A5A | 0.56044 | 0.714286 |
31 | 5CA | 0.55914 | 0.729412 |
32 | 62X | 0.557895 | 0.828947 |
33 | SAM | 0.555556 | 0.888889 |
34 | EP4 | 0.551282 | 0.842857 |
35 | A5D | 0.550562 | 0.855072 |
36 | KYE | 0.55 | 0.84 |
37 | 54H | 0.548387 | 0.697674 |
38 | VMS | 0.548387 | 0.697674 |
39 | 0UM | 0.547368 | 0.849315 |
40 | LSS | 0.547368 | 0.712644 |
41 | GSU | 0.546392 | 0.75 |
42 | KG4 | 0.545455 | 0.789474 |
43 | G5A | 0.544444 | 0.729412 |
44 | 53H | 0.542553 | 0.689655 |
45 | TSB | 0.542553 | 0.705882 |
46 | AMP MG | 0.542169 | 0.794521 |
47 | 6RE | 0.542169 | 0.821918 |
48 | SON | 0.54023 | 0.802632 |
49 | SRP | 0.537634 | 0.826667 |
50 | CA0 | 0.534091 | 0.789474 |
51 | ADX | 0.534091 | 0.710843 |
52 | AAT | 0.532609 | 0.835616 |
53 | 5AL | 0.532609 | 0.8 |
54 | NWW | 0.532468 | 0.830769 |
55 | TT8 | 0.531915 | 0.941176 |
56 | 52H | 0.531915 | 0.689655 |
57 | AMO | 0.53125 | 0.826667 |
58 | KAA | 0.530612 | 0.704545 |
59 | J7C | 0.529412 | 0.833333 |
60 | A2D | 0.529412 | 0.763158 |
61 | ABM | 0.529412 | 0.763158 |
62 | 45A | 0.529412 | 0.763158 |
63 | ADP | 0.528736 | 0.763158 |
64 | 5AS | 0.528736 | 0.670455 |
65 | AHX | 0.525773 | 0.772152 |
66 | NVA LMS | 0.525773 | 0.704545 |
67 | SRA | 0.52381 | 0.766234 |
68 | S4M | 0.523256 | 0.805195 |
69 | GJV | 0.523256 | 0.810811 |
70 | A3S | 0.522727 | 0.910448 |
71 | AN2 | 0.522727 | 0.753247 |
72 | 8QN | 0.520833 | 0.8 |
73 | KB1 | 0.52 | 0.875 |
74 | YSA | 0.519608 | 0.729412 |
75 | AOC | 0.517647 | 0.867647 |
76 | AP2 | 0.517241 | 0.75641 |
77 | BA3 | 0.517241 | 0.763158 |
78 | A12 | 0.517241 | 0.75641 |
79 | V2G | 0.516129 | 0.772152 |
80 | NSS | 0.515464 | 0.729412 |
81 | ZAS | 0.511905 | 0.830986 |
82 | AP5 | 0.511364 | 0.763158 |
83 | B4P | 0.511364 | 0.763158 |
84 | HEJ | 0.511111 | 0.763158 |
85 | 50T | 0.511111 | 0.753247 |
86 | ATP | 0.511111 | 0.763158 |
87 | 8X1 | 0.510417 | 0.704545 |
88 | ME8 | 0.51 | 0.810127 |
89 | ADP BEF | 0.505618 | 0.783784 |
90 | ADP MG | 0.505618 | 0.783784 |
91 | AT4 | 0.505618 | 0.75641 |
92 | APC | 0.505495 | 0.75641 |
93 | 5FA | 0.505495 | 0.763158 |
94 | AQP | 0.505495 | 0.763158 |
95 | GAP | 0.505376 | 0.789474 |
96 | 8LH | 0.505263 | 0.779221 |
97 | GEK | 0.505155 | 0.927536 |
98 | A6D | 0.50505 | 0.75641 |
99 | M33 | 0.5 | 0.753247 |
100 | HY8 | 0.5 | 0.863014 |
101 | 7D7 | 0.5 | 0.782609 |
102 | LAD | 0.5 | 0.78481 |
103 | NEC | 0.5 | 0.811594 |
104 | KXW | 0.5 | 0.887324 |
105 | 8LE | 0.5 | 0.769231 |
106 | WAQ | 0.5 | 0.782051 |
107 | MAO | 0.5 | 0.772152 |
108 | A3G | 0.5 | 0.897059 |
109 | AU1 | 0.5 | 0.74359 |
110 | 3AM | 0.5 | 0.746667 |
111 | HZ2 | 0.495327 | 0.863014 |
112 | 8PZ | 0.495146 | 0.729412 |
113 | NB8 | 0.49505 | 0.794872 |
114 | PTJ | 0.49505 | 0.75 |
115 | TXA | 0.49505 | 0.779221 |
116 | QA7 | 0.494845 | 0.769231 |
117 | DAL AMP | 0.494845 | 0.8 |
118 | D3Y | 0.494845 | 0.884058 |
119 | 8LQ | 0.494845 | 0.802632 |
120 | A3T | 0.494505 | 0.867647 |
121 | ACP | 0.494505 | 0.766234 |
122 | A3N | 0.494253 | 0.855072 |
123 | 7D5 | 0.493976 | 0.705128 |
124 | OZP | 0.490741 | 0.887324 |
125 | XAH | 0.490385 | 0.743902 |
126 | 9ZD | 0.489796 | 0.759494 |
127 | 9ZA | 0.489796 | 0.759494 |
128 | 25A | 0.489796 | 0.763158 |
129 | V47 | 0.489583 | 0.880597 |
130 | TAT | 0.489362 | 0.75641 |
131 | T99 | 0.489362 | 0.75641 |
132 | ACQ | 0.489362 | 0.766234 |
133 | AR6 | 0.48913 | 0.786667 |
134 | PRX | 0.48913 | 0.74359 |
135 | APR | 0.48913 | 0.786667 |
136 | 5AD | 0.486842 | 0.815385 |
137 | EU9 | 0.486239 | 0.8 |
138 | KH3 | 0.485981 | 0.84 |
139 | J4G | 0.485149 | 0.815789 |
140 | P5A | 0.485149 | 0.696629 |
141 | PAJ | 0.484848 | 0.740741 |
142 | 4AD | 0.484848 | 0.815789 |
143 | ATP MG | 0.483871 | 0.783784 |
144 | APC MG | 0.483871 | 0.763158 |
145 | AGS | 0.483871 | 0.746835 |
146 | AD9 | 0.483871 | 0.74359 |
147 | RBY | 0.483871 | 0.779221 |
148 | ADP PO3 | 0.483871 | 0.783784 |
149 | ADV | 0.483871 | 0.779221 |
150 | A3P | 0.483146 | 0.76 |
151 | N5O | 0.482759 | 0.855072 |
152 | 80F | 0.482759 | 0.768293 |
153 | Y3J | 0.481013 | 0.791045 |
154 | FA5 | 0.480769 | 0.826667 |
155 | A22 | 0.479592 | 0.753247 |
156 | BEF ADP | 0.478723 | 0.763158 |
157 | VRT | 0.478723 | 0.859155 |
158 | H1Q | 0.478261 | 0.773333 |
159 | 2VA | 0.478261 | 0.842857 |
160 | F0P | 0.477477 | 0.887324 |
161 | 7MD | 0.476636 | 0.765432 |
162 | LEU LMS | 0.475248 | 0.741176 |
163 | QXP | 0.474747 | 0.714286 |
164 | OOB | 0.474747 | 0.8 |
165 | 6YZ | 0.474227 | 0.766234 |
166 | ANP | 0.473684 | 0.74359 |
167 | TAD | 0.472222 | 0.7625 |
168 | N5A | 0.47191 | 0.852941 |
169 | 3NZ | 0.470588 | 0.847222 |
170 | NWQ | 0.470588 | 0.80597 |
171 | 2AM | 0.470588 | 0.736842 |
172 | A1R | 0.47 | 0.759494 |
173 | HQG | 0.469388 | 0.776316 |
174 | N37 | 0.468468 | 0.871429 |
175 | WSA | 0.468468 | 0.738095 |
176 | NVA 2AD | 0.468085 | 0.847222 |
177 | MHZ | 0.467391 | 0.772152 |
178 | A2P | 0.466667 | 0.746667 |
179 | 00A | 0.465347 | 0.759494 |
180 | DLL | 0.465347 | 0.8 |
181 | KY2 | 0.464646 | 0.813333 |
182 | Q2M | 0.464286 | 0.888889 |
183 | YLC | 0.464286 | 0.765432 |
184 | 8Q2 | 0.464286 | 0.704545 |
185 | Q34 | 0.464286 | 0.84 |
186 | ANP MG | 0.463918 | 0.753247 |
187 | ALF ADP | 0.463918 | 0.725 |
188 | VO4 ADP | 0.463918 | 0.74359 |
189 | ATF | 0.463918 | 0.734177 |
190 | SO8 | 0.463158 | 0.830986 |
191 | B1U | 0.462264 | 0.652174 |
192 | 3UK | 0.460784 | 0.789474 |
193 | QXG | 0.460784 | 0.705882 |
194 | OAD | 0.460784 | 0.789474 |
195 | 4YB | 0.458716 | 0.732558 |
196 | 0XU | 0.457447 | 0.895522 |
197 | F2R | 0.456897 | 0.746988 |
198 | R2V | 0.456311 | 0.714286 |
199 | PR8 | 0.456311 | 0.775 |
200 | B5V | 0.456311 | 0.779221 |
201 | IOT | 0.45614 | 0.738095 |
202 | KYB | 0.455446 | 0.813333 |
203 | A3R | 0.455446 | 0.759494 |
204 | ADQ | 0.455446 | 0.766234 |
205 | OVE | 0.454545 | 0.730769 |
206 | PPS | 0.453608 | 0.690476 |
207 | Q2V | 0.452174 | 0.875 |
208 | FYA | 0.451923 | 0.8 |
209 | BIS | 0.451923 | 0.716049 |
210 | 1ZZ | 0.451923 | 0.722892 |
211 | 3OD | 0.451923 | 0.789474 |
212 | 9K8 | 0.451923 | 0.685393 |
213 | JNT | 0.45098 | 0.766234 |
214 | 48N | 0.45045 | 0.772152 |
215 | YLP | 0.45045 | 0.746988 |
216 | MAP | 0.45 | 0.725 |
217 | 4UU | 0.449541 | 0.769231 |
218 | ARG AMP | 0.449541 | 0.756098 |
219 | 25L | 0.447619 | 0.753247 |
220 | MYR AMP | 0.447619 | 0.722892 |
221 | ADP BMA | 0.446602 | 0.766234 |
222 | 9X8 | 0.446602 | 0.769231 |
223 | 36A | 0.446429 | 0.876712 |
224 | OZV | 0.445545 | 0.763158 |
225 | 5SV | 0.445545 | 0.707317 |
226 | 4UV | 0.444444 | 0.769231 |
227 | 9SN | 0.443396 | 0.75 |
228 | V3L | 0.443299 | 0.786667 |
229 | NX8 | 0.443299 | 0.847222 |
230 | TYM | 0.442478 | 0.826667 |
231 | Q2P | 0.440678 | 0.84 |
232 | 7D3 | 0.43956 | 0.6875 |
233 | B5M | 0.439252 | 0.769231 |
234 | K3K | 0.439252 | 0.819444 |
235 | B5Y | 0.439252 | 0.769231 |
236 | 7MC | 0.438596 | 0.746988 |
237 | YLB | 0.438596 | 0.746988 |
238 | JB6 | 0.438095 | 0.759494 |
239 | PAP | 0.4375 | 0.75 |
240 | DQV | 0.432432 | 0.776316 |
241 | AMP DBH | 0.431193 | 0.766234 |
242 | KL2 | 0.430233 | 0.710526 |
243 | K38 | 0.429907 | 0.819444 |
244 | 649 | 0.429825 | 0.696629 |
245 | OMR | 0.429825 | 0.714286 |
246 | LAQ | 0.428571 | 0.743902 |
247 | YLA | 0.42735 | 0.746988 |
248 | 7C5 | 0.427273 | 0.810811 |
249 | 2A5 | 0.427083 | 0.721519 |
250 | ACK | 0.426966 | 0.72973 |
251 | QQY | 0.426966 | 0.714286 |
252 | L3W | 0.426087 | 0.75641 |
253 | ATP A A A | 0.425926 | 0.773333 |
254 | ATP A | 0.425926 | 0.773333 |
255 | KMQ | 0.425926 | 0.75641 |
256 | CC5 | 0.425 | 0.892308 |
257 | KOY | 0.424779 | 0.84507 |
258 | LPA AMP | 0.424779 | 0.743902 |
259 | AYB | 0.423729 | 0.738095 |
260 | ATR | 0.42268 | 0.736842 |
261 | K3H | 0.422018 | 0.786667 |
262 | K2W | 0.422018 | 0.824324 |
263 | MTP | 0.421687 | 0.767123 |
264 | 3L1 | 0.421687 | 0.84058 |
265 | 3AD | 0.421687 | 0.878788 |
266 | 3D1 | 0.421687 | 0.84058 |
267 | 7D4 | 0.421053 | 0.6875 |
268 | NAI | 0.421053 | 0.7375 |
269 | DND | 0.421053 | 0.779221 |
270 | 4UW | 0.421053 | 0.740741 |
271 | TXD | 0.421053 | 0.759494 |
272 | NAX | 0.421053 | 0.753086 |
273 | K3E | 0.418182 | 0.808219 |
274 | AF3 ADP 3PG | 0.417391 | 0.7625 |
275 | ALF ADP 3PG | 0.417391 | 0.7625 |
276 | TXE | 0.417391 | 0.7375 |
277 | AHZ | 0.415929 | 0.743902 |
278 | QQX | 0.41573 | 0.705128 |
279 | NWZ | 0.412371 | 0.833333 |
280 | A2R | 0.411765 | 0.776316 |
281 | SP1 | 0.411111 | 0.74026 |
282 | RP1 | 0.411111 | 0.74026 |
283 | AR6 AR6 | 0.410714 | 0.786667 |
284 | AFH | 0.410714 | 0.740741 |
285 | GA7 | 0.410714 | 0.75641 |
286 | K2H | 0.409524 | 0.819444 |
287 | 6V0 | 0.408696 | 0.728395 |
288 | KY5 | 0.407407 | 0.859155 |
289 | 101 | 0.406593 | 0.727273 |
290 | SLU | 0.406504 | 0.681818 |
291 | 2SA | 0.405941 | 0.802632 |
292 | 2BA | 0.404255 | 0.756757 |
293 | CMP | 0.404255 | 0.767123 |
294 | J1A | 0.403226 | 0.797468 |
295 | DA | 0.402174 | 0.75 |
296 | D5M | 0.402174 | 0.75 |
297 | KY8 | 0.401869 | 0.835616 |
298 | K2K | 0.401869 | 0.847222 |
299 | G3A | 0.401786 | 0.728395 |
300 | NAD TDB | 0.401709 | 0.786667 |
301 | AP0 | 0.401709 | 0.707317 |
302 | NAD IBO | 0.401709 | 0.786667 |
303 | N0B | 0.401575 | 0.746988 |
304 | 2FA | 0.4 | 0.805556 |
305 | CNA | 0.4 | 0.779221 |
306 | 26A | 0.4 | 0.802817 |
307 | YLY | 0.4 | 0.738095 |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | SAH | 1 | 1 |
2 | 5X8 | 0.759494 | 0.969697 |
3 | A7D | 0.734177 | 0.926471 |
4 | TT8 | 0.709302 | 0.970588 |
5 | DSH | 0.692308 | 0.914286 |
6 | SXZ | 0.692308 | 0.916667 |
7 | DTA | 0.666667 | 0.857143 |
8 | 3DH | 0.662338 | 0.869565 |
9 | S8M | 0.655556 | 0.901408 |
10 | U4Y | 0.64 | 0.956522 |
11 | SFG | 0.635294 | 0.954545 |
12 | SA8 | 0.62069 | 0.915493 |
13 | EEM | 0.617977 | 0.890411 |
14 | MTA | 0.615385 | 0.869565 |
15 | SAI | 0.613636 | 0.955882 |
16 | S7M | 0.586957 | 0.916667 |
17 | 36A | 0.586538 | 0.90411 |
18 | K15 | 0.583333 | 0.878378 |
19 | ADN | 0.573333 | 0.84058 |
20 | RAB | 0.573333 | 0.84058 |
21 | XYA | 0.573333 | 0.84058 |
22 | 62X | 0.572917 | 0.855263 |
23 | 5CD | 0.571429 | 0.852941 |
24 | 0UM | 0.5625 | 0.876712 |
25 | 5N5 | 0.558442 | 0.84058 |
26 | A4D | 0.551282 | 0.867647 |
27 | KYE | 0.54902 | 0.866667 |
28 | SAM | 0.537634 | 0.916667 |
29 | SSA | 0.536842 | 0.712644 |
30 | SMM | 0.536842 | 0.88 |
31 | KB1 | 0.534653 | 0.902778 |
32 | A5D | 0.532609 | 0.857143 |
33 | SIB | 0.53125 | 0.928571 |
34 | EP4 | 0.530864 | 0.819444 |
35 | DSZ | 0.530612 | 0.732558 |
36 | GSU | 0.53 | 0.752941 |
37 | LMS | 0.529412 | 0.694118 |
38 | AMP | 0.529412 | 0.763158 |
39 | A | 0.529412 | 0.763158 |
40 | 5CA | 0.525773 | 0.712644 |
41 | ME8 | 0.524752 | 0.8125 |
42 | M2T | 0.52439 | 0.821918 |
43 | 6RE | 0.523256 | 0.824324 |
44 | GJV | 0.522727 | 0.813333 |
45 | OZP | 0.518519 | 0.915493 |
46 | AAT | 0.515789 | 0.863014 |
47 | LSS | 0.515152 | 0.696629 |
48 | KAA | 0.514852 | 0.727273 |
49 | KXW | 0.514019 | 0.915493 |
50 | NWW | 0.5125 | 0.80597 |
51 | J7C | 0.511364 | 0.835616 |
52 | KG4 | 0.51087 | 0.769231 |
53 | A5A | 0.510417 | 0.697674 |
54 | AMP MG | 0.505747 | 0.773333 |
55 | SON | 0.505495 | 0.805195 |
56 | SRP | 0.505155 | 0.805195 |
57 | F0P | 0.504505 | 0.915493 |
58 | KH3 | 0.5 | 0.866667 |
59 | HY8 | 0.5 | 0.890411 |
60 | CA0 | 0.5 | 0.769231 |
61 | AMO | 0.5 | 0.805195 |
62 | 54H | 0.5 | 0.681818 |
63 | ADX | 0.5 | 0.694118 |
64 | 5AL | 0.5 | 0.779221 |
65 | VMS | 0.5 | 0.681818 |
66 | N37 | 0.495495 | 0.9 |
67 | HZ2 | 0.495413 | 0.890411 |
68 | NVA LMS | 0.49505 | 0.707865 |
69 | AHX | 0.49505 | 0.753086 |
70 | TSB | 0.494949 | 0.689655 |
71 | 53H | 0.494949 | 0.674157 |
72 | G5A | 0.494737 | 0.712644 |
73 | 45A | 0.494382 | 0.74359 |
74 | ABM | 0.494382 | 0.74359 |
75 | A2D | 0.494382 | 0.74359 |
76 | ZAS | 0.494253 | 0.808219 |
77 | A6D | 0.490196 | 0.759494 |
78 | GEK | 0.49 | 0.956522 |
79 | 8QN | 0.49 | 0.779221 |
80 | GAP | 0.489583 | 0.769231 |
81 | A3S | 0.48913 | 0.884058 |
82 | AN2 | 0.48913 | 0.734177 |
83 | S4M | 0.488889 | 0.831169 |
84 | SRA | 0.488636 | 0.746835 |
85 | EU9 | 0.486486 | 0.825 |
86 | LAD | 0.485437 | 0.810127 |
87 | 52H | 0.484848 | 0.674157 |
88 | V2G | 0.484536 | 0.753086 |
89 | BA3 | 0.483516 | 0.74359 |
90 | AP2 | 0.483516 | 0.759494 |
91 | A12 | 0.483516 | 0.759494 |
92 | AOC | 0.483146 | 0.842857 |
93 | NEC | 0.483146 | 0.788732 |
94 | Y3J | 0.481481 | 0.768116 |
95 | VRT | 0.479167 | 0.861111 |
96 | 50T | 0.478723 | 0.734177 |
97 | AP5 | 0.478261 | 0.74359 |
98 | ADP | 0.478261 | 0.74359 |
99 | 5AS | 0.478261 | 0.655556 |
100 | B4P | 0.478261 | 0.74359 |
101 | Q34 | 0.477876 | 0.866667 |
102 | Q2M | 0.477876 | 0.916667 |
103 | A3N | 0.477778 | 0.830986 |
104 | YSA | 0.476636 | 0.712644 |
105 | XAH | 0.476636 | 0.768293 |
106 | 8LH | 0.474747 | 0.759494 |
107 | V47 | 0.474747 | 0.882353 |
108 | 0XU | 0.473684 | 0.897059 |
109 | AT4 | 0.473118 | 0.7375 |
110 | ADP MG | 0.473118 | 0.763158 |
111 | ADP BEF | 0.473118 | 0.763158 |
112 | J4G | 0.471154 | 0.818182 |
113 | WAQ | 0.471154 | 0.807692 |
114 | NSS | 0.470588 | 0.712644 |
115 | 8LE | 0.469388 | 0.75 |
116 | 5AD | 0.468354 | 0.791045 |
117 | AU1 | 0.468085 | 0.725 |
118 | M33 | 0.468085 | 0.734177 |
119 | MAO | 0.467391 | 0.797468 |
120 | NB8 | 0.466667 | 0.775 |
121 | A3G | 0.466667 | 0.871429 |
122 | N5O | 0.466667 | 0.857143 |
123 | TXA | 0.466667 | 0.759494 |
124 | 3AM | 0.465909 | 0.727273 |
125 | Q2V | 0.465517 | 0.902778 |
126 | QA7 | 0.465347 | 0.75 |
127 | 8X1 | 0.465347 | 0.707865 |
128 | DAL AMP | 0.465347 | 0.779221 |
129 | 8LQ | 0.465347 | 0.782051 |
130 | A3T | 0.463158 | 0.842857 |
131 | ATP | 0.463158 | 0.74359 |
132 | ACP | 0.463158 | 0.746835 |
133 | HEJ | 0.463158 | 0.74359 |
134 | 7D7 | 0.4625 | 0.785714 |
135 | QXP | 0.460784 | 0.697674 |
136 | 9ZA | 0.460784 | 0.740741 |
137 | 9ZD | 0.460784 | 0.740741 |
138 | APR | 0.458333 | 0.766234 |
139 | 5FA | 0.458333 | 0.74359 |
140 | PRX | 0.458333 | 0.746835 |
141 | APC | 0.458333 | 0.759494 |
142 | AQP | 0.458333 | 0.74359 |
143 | AR6 | 0.458333 | 0.766234 |
144 | F2R | 0.457627 | 0.75 |
145 | R2V | 0.457143 | 0.697674 |
146 | IOT | 0.456897 | 0.761905 |
147 | N5A | 0.456522 | 0.855072 |
148 | PAJ | 0.456311 | 0.722892 |
149 | 4AD | 0.456311 | 0.794872 |
150 | WSA | 0.45614 | 0.72093 |
151 | HQG | 0.455446 | 0.75641 |
152 | NWQ | 0.454545 | 0.782609 |
153 | Q2P | 0.453782 | 0.866667 |
154 | 8PZ | 0.453704 | 0.712644 |
155 | FA5 | 0.453704 | 0.805195 |
156 | AGS | 0.453608 | 0.728395 |
157 | APC MG | 0.453608 | 0.766234 |
158 | RBY | 0.453608 | 0.782051 |
159 | ATP MG | 0.453608 | 0.763158 |
160 | AD9 | 0.453608 | 0.725 |
161 | ADV | 0.453608 | 0.782051 |
162 | NVA 2AD | 0.453608 | 0.849315 |
163 | ADP PO3 | 0.453608 | 0.763158 |
164 | PTJ | 0.45283 | 0.731707 |
165 | MHZ | 0.452632 | 0.797468 |
166 | 00A | 0.451923 | 0.740741 |
167 | A3P | 0.451613 | 0.74026 |
168 | YLP | 0.451327 | 0.771084 |
169 | 7MD | 0.45045 | 0.768293 |
170 | ALF ADP | 0.45 | 0.707317 |
171 | BEF ADP | 0.44898 | 0.74359 |
172 | 2VA | 0.447917 | 0.819444 |
173 | H1Q | 0.447917 | 0.753247 |
174 | LEU LMS | 0.447619 | 0.724138 |
175 | QXG | 0.447619 | 0.689655 |
176 | OOB | 0.446602 | 0.779221 |
177 | ACQ | 0.444444 | 0.746835 |
178 | T99 | 0.444444 | 0.7375 |
179 | TAT | 0.444444 | 0.7375 |
180 | ANP | 0.444444 | 0.725 |
181 | P5A | 0.443396 | 0.719101 |
182 | 7D5 | 0.443182 | 0.708861 |
183 | A1R | 0.442308 | 0.7625 |
184 | YLC | 0.439655 | 0.790123 |
185 | 2AM | 0.438202 | 0.717949 |
186 | DLL | 0.438095 | 0.779221 |
187 | ARG AMP | 0.4375 | 0.759036 |
188 | KY2 | 0.436893 | 0.84 |
189 | D3Y | 0.436893 | 0.859155 |
190 | A22 | 0.436893 | 0.734177 |
191 | ANP MG | 0.435644 | 0.734177 |
192 | VO4 ADP | 0.435644 | 0.725 |
193 | ATF | 0.435644 | 0.716049 |
194 | MYR AMP | 0.435185 | 0.746988 |
195 | 80F | 0.434426 | 0.75 |
196 | SO8 | 0.434343 | 0.808219 |
197 | OAD | 0.433962 | 0.769231 |
198 | 3UK | 0.433962 | 0.769231 |
199 | TAD | 0.433628 | 0.765432 |
200 | 25A | 0.432692 | 0.74359 |
201 | 6YZ | 0.431373 | 0.746835 |
202 | 9SN | 0.431193 | 0.731707 |
203 | TYM | 0.431034 | 0.805195 |
204 | PR8 | 0.429907 | 0.8 |
205 | B5V | 0.429907 | 0.759494 |
206 | KYB | 0.428571 | 0.84 |
207 | ADQ | 0.428571 | 0.746835 |
208 | YLB | 0.42735 | 0.771084 |
209 | 1ZZ | 0.425926 | 0.746988 |
210 | 9K8 | 0.425926 | 0.67033 |
211 | 3OD | 0.425926 | 0.769231 |
212 | FYA | 0.425926 | 0.779221 |
213 | PPS | 0.425743 | 0.674419 |
214 | JNT | 0.424528 | 0.746835 |
215 | B1U | 0.423423 | 0.638298 |
216 | MAP | 0.423077 | 0.707317 |
217 | 4YB | 0.421053 | 0.735632 |
218 | A2P | 0.421053 | 0.727273 |
219 | 9X8 | 0.420561 | 0.75 |
220 | ADP BMA | 0.420561 | 0.746835 |
221 | OZV | 0.419048 | 0.74359 |
222 | 5SV | 0.419048 | 0.731707 |
223 | YLA | 0.416667 | 0.771084 |
224 | 3NZ | 0.416667 | 0.824324 |
225 | NX8 | 0.415842 | 0.875 |
226 | KL2 | 0.41573 | 0.692308 |
227 | 8Q2 | 0.415254 | 0.688889 |
228 | A3R | 0.415094 | 0.7625 |
229 | B5M | 0.414414 | 0.75 |
230 | B5Y | 0.414414 | 0.75 |
231 | LPA AMP | 0.413793 | 0.768293 |
232 | 48N | 0.413793 | 0.753086 |
233 | AYB | 0.413223 | 0.761905 |
234 | ACK | 0.413043 | 0.710526 |
235 | QQY | 0.413043 | 0.696203 |
236 | JB6 | 0.412844 | 0.7625 |
237 | BIS | 0.412844 | 0.719512 |
238 | K2H | 0.411215 | 0.797297 |
239 | PAP | 0.41 | 0.730769 |
240 | KY5 | 0.409091 | 0.887324 |
241 | DQV | 0.408696 | 0.75641 |
242 | OVE | 0.408602 | 0.7125 |
243 | 4UV | 0.40708 | 0.75 |
244 | AMP DBH | 0.40708 | 0.746835 |
245 | 3AD | 0.406977 | 0.852941 |
246 | OMR | 0.40678 | 0.738095 |
247 | AF3 ADP 3PG | 0.40678 | 0.743902 |
248 | K38 | 0.405405 | 0.797297 |
249 | LAQ | 0.405172 | 0.768293 |
250 | K2K | 0.40367 | 0.875 |
251 | 7C5 | 0.403509 | 0.789474 |
252 | 7MC | 0.403361 | 0.75 |
253 | K3K | 0.401786 | 0.797297 |
254 | KOY | 0.401709 | 0.847222 |
255 | NWZ | 0.4 | 0.861111 |
256 | 4UU | 0.4 | 0.75 |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | MED | 1 | 1 |
2 | MET | 1 | 1 |
3 | DBB | 0.518519 | 0.655172 |
4 | ABA | 0.518519 | 0.655172 |
5 | 2FM | 0.514286 | 0.666667 |
6 | MF3 | 0.5 | 0.647059 |
7 | NVA | 0.5 | 0.758621 |
8 | B3M | 0.472222 | 0.8125 |
9 | HSE | 0.466667 | 0.617647 |
10 | DAB | 0.466667 | 0.636364 |
11 | MHO | 0.457143 | 0.717949 |
12 | SME | 0.457143 | 0.717949 |
13 | HCS | 0.451613 | 0.733333 |
14 | API | 0.451613 | 0.606061 |
15 | CDT | 0.447368 | 0.756757 |
16 | 2MM | 0.444444 | 0.657143 |
17 | NLE | 0.441176 | 0.766667 |
18 | ONL | 0.441176 | 0.71875 |
19 | UN1 | 0.428571 | 0.606061 |
20 | 11C | 0.428571 | 0.606061 |
21 | MSE | 0.428571 | 0.9 |
22 | GLU | 0.424242 | 0.625 |
23 | GGL | 0.424242 | 0.625 |
24 | DGL | 0.424242 | 0.625 |
25 | CBH | 0.418605 | 0.685714 |
26 | ORN | 0.411765 | 0.65625 |
27 | AME | 0.410256 | 0.771429 |
28 | FME | 0.410256 | 0.84375 |
29 | LEU | 0.40625 | 0.666667 |
30 | CYS | 0.4 | 0.666667 |
31 | DCY | 0.4 | 0.666667 |
32 | C2N | 0.4 | 0.633333 |
33 | JM6 | 0.4 | 0.7 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 5AD SEC | 0.9968 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 9SE | 0.9989 |
2 | 5XB | 0.9676 |
3 | APG | 0.9498 |
4 | GLU | 0.9328 |
5 | R9S | 0.9320 |
6 | 3LR | 0.9313 |
7 | 8GL | 0.9309 |
8 | 2FT | 0.9303 |
9 | ALA ALA | 0.9287 |
10 | OGA | 0.9252 |
11 | 7UC | 0.9236 |
12 | SYM | 0.9234 |
13 | GRO | 0.9200 |
14 | KDG | 0.9195 |
15 | ICB | 0.9186 |
16 | HIS | 0.9180 |
17 | FK8 | 0.9180 |
18 | DAL DAL | 0.9179 |
19 | KMH | 0.9179 |
20 | DHS | 0.9177 |
21 | 6JN | 0.9175 |
22 | 0OC | 0.9168 |
23 | TRC | 0.9163 |
24 | GLN | 0.9161 |
25 | 8EW | 0.9158 |
26 | AKG | 0.9157 |
27 | URQ | 0.9151 |
28 | SMN | 0.9141 |
29 | GGL | 0.9135 |
30 | DGL | 0.9132 |
31 | KDF | 0.9129 |
32 | 9RW | 0.9121 |
33 | FOC | 0.9109 |
34 | 2HG | 0.9107 |
35 | DZA | 0.9100 |
36 | XYH | 0.9097 |
37 | M5E | 0.9095 |
38 | OMD | 0.9086 |
39 | DGN | 0.9081 |
40 | TLA | 0.9080 |
41 | 9ON | 0.9079 |
42 | CIT | 0.9076 |
43 | SKG | 0.9072 |
44 | 40F | 0.9067 |
45 | HA7 | 0.9066 |
46 | RAT | 0.9064 |
47 | TPO | 0.9063 |
48 | 2IT | 0.9061 |
49 | PEQ | 0.9056 |
50 | 173 | 0.9053 |
51 | SOR | 0.9049 |
52 | 3CR | 0.9045 |
53 | LFC | 0.9045 |
54 | K6H | 0.9044 |
55 | SEP | 0.9044 |
56 | PEP | 0.9040 |
57 | T9G | 0.9037 |
58 | XYS | 0.9035 |
59 | 4HP | 0.9030 |
60 | 152 | 0.9024 |
61 | 3HG | 0.9024 |
62 | MUC | 0.9019 |
63 | 3PG | 0.9016 |
64 | 091 | 0.9016 |
65 | AL0 | 0.9014 |
66 | PHE | 0.9009 |
67 | MTL | 0.9007 |
68 | N8P | 0.9007 |
69 | GCO | 0.9005 |
70 | DIR | 0.8997 |
71 | DGJ | 0.8995 |
72 | AHN | 0.8995 |
73 | GAE | 0.8992 |
74 | CUW | 0.8992 |
75 | GLR | 0.8991 |
76 | 8OZ | 0.8988 |
77 | TSR | 0.8987 |
78 | 92K | 0.8983 |
79 | DXG | 0.8981 |
80 | 3BU | 0.8979 |
81 | GZQ | 0.8978 |
82 | AFS | 0.8976 |
83 | RNS | 0.8975 |
84 | 6NT | 0.8973 |
85 | SD4 | 0.8972 |
86 | TAR | 0.8970 |
87 | A29 | 0.8969 |
88 | C5A | 0.8967 |
89 | FLC | 0.8966 |
90 | ZGL | 0.8963 |
91 | 4TB | 0.8961 |
92 | RMN | 0.8961 |
93 | 1L5 | 0.8957 |
94 | GVM | 0.8956 |
95 | AOS | 0.8956 |
96 | HIO | 0.8955 |
97 | CS2 | 0.8950 |
98 | TIU | 0.8950 |
99 | J0Z | 0.8948 |
100 | 3NY | 0.8948 |
101 | FIX | 0.8937 |
102 | PD2 | 0.8937 |
103 | PDC | 0.8934 |
104 | FUD | 0.8933 |
105 | GOJ | 0.8932 |
106 | HHH | 0.8932 |
107 | SOL | 0.8931 |
108 | ICT | 0.8931 |
109 | HQ9 | 0.8926 |
110 | LLH | 0.8922 |
111 | OSE | 0.8921 |
112 | SRT | 0.8917 |
113 | XYL | 0.8915 |
114 | 3SL | 0.8913 |
115 | CGB | 0.8908 |
116 | IXW | 0.8906 |
117 | ROR | 0.8905 |
118 | 3YP | 0.8905 |
119 | XXP | 0.8903 |
120 | NCT | 0.8903 |
121 | LNR | 0.8903 |
122 | CAX | 0.8902 |
123 | K7M | 0.8902 |
124 | S7A | 0.8902 |
125 | S2P | 0.8901 |
126 | GLA | 0.8901 |
127 | 61M | 0.8900 |
128 | 9RH | 0.8900 |
129 | G8M | 0.8899 |
130 | NLG | 0.8898 |
131 | 5FX | 0.8898 |
132 | 4P0 | 0.8898 |
133 | HL5 | 0.8897 |
134 | DHI | 0.8895 |
135 | M6H | 0.8895 |
136 | DEW | 0.8894 |
137 | 2ZM | 0.8894 |
138 | LPK | 0.8894 |
139 | GLO | 0.8894 |
140 | SDD | 0.8891 |
141 | 5NI | 0.8891 |
142 | 7C3 | 0.8891 |
143 | 23J | 0.8890 |
144 | 449 | 0.8890 |
145 | KTA | 0.8888 |
146 | XLS | 0.8886 |
147 | CXP | 0.8884 |
148 | DMV | 0.8882 |
149 | HL4 | 0.8878 |
150 | EHM | 0.8878 |
151 | XUL | 0.8878 |
152 | S2G | 0.8877 |
153 | 56D | 0.8877 |
154 | 2AS | 0.8877 |
155 | KDO | 0.8874 |
156 | FA3 | 0.8874 |
157 | AH8 | 0.8871 |
158 | YZM | 0.8868 |
159 | 51R | 0.8867 |
160 | LYS | 0.8866 |
161 | DII | 0.8865 |
162 | 0HN | 0.8865 |
163 | GZ3 | 0.8865 |
164 | PSJ | 0.8863 |
165 | 2BX | 0.8861 |
166 | 6NI | 0.8861 |
167 | 1F1 | 0.8859 |
168 | REL | 0.8858 |
169 | RBL | 0.8858 |
170 | PAC | 0.8858 |
171 | K6V | 0.8855 |
172 | 7A3 | 0.8852 |
173 | 2AL | 0.8852 |
174 | GXL | 0.8850 |
175 | 4PN | 0.8850 |
176 | 9J3 | 0.8847 |
177 | ACH | 0.8846 |
178 | DHY | 0.8846 |
179 | SYC | 0.8844 |
180 | AOT | 0.8843 |
181 | 6M4 | 0.8843 |
182 | HDL | 0.8842 |
183 | DYT | 0.8840 |
184 | 4NC | 0.8840 |
185 | PFL | 0.8839 |
186 | FF3 | 0.8837 |
187 | P58 | 0.8836 |
188 | NCD | 0.8834 |
189 | JAW | 0.8832 |
190 | 0HO | 0.8832 |
191 | 5OB | 0.8832 |
192 | GCS | 0.8832 |
193 | HCI | 0.8831 |
194 | O45 | 0.8830 |
195 | HBU | 0.8829 |
196 | PPY | 0.8828 |
197 | ONL | 0.8827 |
198 | MLT | 0.8827 |
199 | ODO | 0.8825 |
200 | GLY GLY | 0.8824 |
201 | LFR | 0.8823 |
202 | TYE | 0.8823 |
203 | MXN | 0.8823 |
204 | M44 | 0.8822 |
205 | ABI | 0.8822 |
206 | DLY | 0.8822 |
207 | R2P | 0.8820 |
208 | Q07 | 0.8819 |
209 | TCA | 0.8819 |
210 | GAL | 0.8819 |
211 | RUJ | 0.8818 |
212 | HYA | 0.8818 |
213 | PAF | 0.8816 |
214 | HNL | 0.8815 |
215 | SHI | 0.8814 |
216 | OAA | 0.8814 |
217 | SNE | 0.8814 |
218 | FEH | 0.8811 |
219 | HDH | 0.8811 |
220 | 1SV | 0.8811 |
221 | BZ3 | 0.8810 |
222 | HHI | 0.8810 |
223 | ORN | 0.8810 |
224 | 3MF | 0.8810 |
225 | TYL | 0.8809 |
226 | 4WK | 0.8807 |
227 | OOG | 0.8806 |
228 | 3V4 | 0.8806 |
229 | ICO | 0.8805 |
230 | 149 | 0.8799 |
231 | E4P | 0.8798 |
232 | 2H5 | 0.8798 |
233 | R67 | 0.8798 |
234 | Q9Z | 0.8797 |
235 | TIH | 0.8796 |
236 | GLC | 0.8795 |
237 | OTR | 0.8792 |
238 | WOO | 0.8792 |
239 | GAF | 0.8791 |
240 | J9Q | 0.8790 |
241 | 98J | 0.8790 |
242 | MR1 | 0.8788 |
243 | GBN | 0.8788 |
244 | HG3 | 0.8788 |
245 | TZM | 0.8784 |
246 | ASP | 0.8784 |
247 | I1E | 0.8781 |
248 | ARB | 0.8781 |
249 | 5HY | 0.8781 |
250 | HNK | 0.8780 |
251 | RB0 | 0.8780 |
252 | RB5 | 0.8780 |
253 | IAC | 0.8779 |
254 | 1AL | 0.8776 |
255 | RBJ | 0.8771 |
256 | X6X | 0.8771 |
257 | MES | 0.8771 |
258 | 3S5 | 0.8768 |
259 | 15N | 0.8768 |
260 | FA1 | 0.8767 |
261 | 1BN | 0.8767 |
262 | PPR | 0.8766 |
263 | 52C | 0.8766 |
264 | 2HU | 0.8765 |
265 | X1R | 0.8764 |
266 | DOB | 0.8764 |
267 | HC4 | 0.8763 |
268 | JDN | 0.8762 |
269 | 1WC | 0.8761 |
270 | ASN | 0.8761 |
271 | N2Z | 0.8760 |
272 | Q06 | 0.8760 |
273 | ASC | 0.8758 |
274 | MET | 0.8758 |
275 | 0V5 | 0.8758 |
276 | BMA | 0.8757 |
277 | PMF | 0.8757 |
278 | AEG | 0.8757 |
279 | BHU | 0.8757 |
280 | A3M | 0.8756 |
281 | OVM | 0.8756 |
282 | JF6 | 0.8755 |
283 | AMQ | 0.8755 |
284 | 3A9 | 0.8754 |
285 | ICF | 0.8752 |
286 | Q03 | 0.8748 |
287 | TAG | 0.8747 |
288 | QY9 | 0.8747 |
289 | 3QM | 0.8746 |
290 | SPV | 0.8745 |
291 | 46P | 0.8742 |
292 | 3C4 | 0.8740 |
293 | N7P | 0.8739 |
294 | HZP | 0.8739 |
295 | GUA | 0.8738 |
296 | PC | 0.8736 |
297 | URO | 0.8735 |
298 | XRG | 0.8735 |
299 | I4B | 0.8734 |
300 | 3MB | 0.8734 |
301 | G4D | 0.8732 |
302 | LX1 | 0.8731 |
303 | SC2 | 0.8731 |
304 | 7WG | 0.8731 |
305 | NDH | 0.8731 |
306 | PIM | 0.8730 |
307 | 3QO | 0.8727 |
308 | 3AL | 0.8727 |
309 | 6FZ | 0.8727 |
310 | S8V | 0.8726 |
311 | 5RN | 0.8726 |
312 | OEM | 0.8724 |
313 | C2Y | 0.8723 |
314 | GVG | 0.8723 |
315 | MZT | 0.8722 |
316 | PHU | 0.8721 |
317 | NVU | 0.8721 |
318 | AT3 | 0.8720 |
319 | RUY | 0.8719 |
320 | LMR | 0.8719 |
321 | ARW | 0.8718 |
322 | UN1 | 0.8718 |
323 | HGA | 0.8716 |
324 | OW4 | 0.8714 |
325 | 0QW | 0.8712 |
326 | 8G0 | 0.8711 |
327 | LDP | 0.8708 |
328 | 3OC | 0.8707 |
329 | BGC | 0.8705 |
330 | 4AV | 0.8705 |
331 | 7A2 | 0.8704 |
332 | CFA | 0.8704 |
333 | E5X | 0.8702 |
334 | VNL | 0.8701 |
335 | FBM | 0.8701 |
336 | E0O | 0.8700 |
337 | 5WZ | 0.8698 |
338 | 0JD | 0.8698 |
339 | 6LW | 0.8697 |
340 | ISZ | 0.8696 |
341 | MNP | 0.8695 |
342 | XX3 | 0.8695 |
343 | MEQ | 0.8692 |
344 | CTS | 0.8691 |
345 | MEV | 0.8690 |
346 | B40 | 0.8690 |
347 | HPP | 0.8688 |
348 | 2PG | 0.8687 |
349 | QUS | 0.8687 |
350 | 86L | 0.8686 |
351 | HFA | 0.8685 |
352 | NIZ | 0.8684 |
353 | HHA | 0.8684 |
354 | B85 | 0.8683 |
355 | ARG | 0.8682 |
356 | OW7 | 0.8682 |
357 | JB8 | 0.8680 |
358 | BDF | 0.8680 |
359 | SHA | 0.8678 |
360 | HSO | 0.8678 |
361 | 4RW | 0.8678 |
362 | AMH | 0.8676 |
363 | CLT | 0.8674 |
364 | BHO | 0.8674 |
365 | PSV | 0.8674 |
366 | 13P | 0.8672 |
367 | MSR | 0.8672 |
368 | SKM | 0.8671 |
369 | IF7 | 0.8671 |
370 | IVL | 0.8670 |
371 | PGH | 0.8670 |
372 | 8U3 | 0.8669 |
373 | 5XC | 0.8669 |
374 | MNM | 0.8668 |
375 | DPN | 0.8667 |
376 | HHT | 0.8665 |
377 | K34 | 0.8664 |
378 | BNL | 0.8664 |
379 | 1X4 | 0.8664 |
380 | PGA | 0.8663 |
381 | M4T | 0.8661 |
382 | BNF | 0.8661 |
383 | AHB | 0.8660 |
384 | 4CS | 0.8659 |
385 | 8WQ | 0.8659 |
386 | NLE | 0.8659 |
387 | GLF | 0.8659 |
388 | M74 | 0.8659 |
389 | 069 | 0.8658 |
390 | TEO | 0.8657 |
391 | 4M0 | 0.8654 |
392 | G3P | 0.8653 |
393 | HPS | 0.8653 |
394 | 3R9 | 0.8652 |
395 | JRB | 0.8651 |
396 | 4P5 | 0.8651 |
397 | TSS | 0.8648 |
398 | 7N0 | 0.8647 |
399 | XDK | 0.8647 |
400 | M45 | 0.8646 |
401 | GLY GLY GLY | 0.8643 |
402 | I2M | 0.8642 |
403 | 5CU | 0.8640 |
404 | CWJ | 0.8639 |
405 | AG2 | 0.8639 |
406 | DQA | 0.8638 |
407 | Q02 | 0.8637 |
408 | F31 | 0.8637 |
409 | 6TZ | 0.8634 |
410 | FA0 | 0.8634 |
411 | 2UB | 0.8633 |
412 | MFU | 0.8633 |
413 | DNF | 0.8630 |
414 | EDR | 0.8630 |
415 | MAJ | 0.8627 |
416 | HNH | 0.8626 |
417 | ILE | 0.8622 |
418 | FOM | 0.8620 |
419 | DAS | 0.8619 |
420 | KOJ | 0.8617 |
421 | PH3 | 0.8616 |
422 | 264 | 0.8616 |
423 | SF6 | 0.8613 |
424 | B2Y | 0.8613 |
425 | URS | 0.8613 |
426 | IPB | 0.8612 |
427 | G3H | 0.8607 |
428 | L13 | 0.8606 |
429 | BHA | 0.8600 |
430 | NYL | 0.8597 |
431 | ACA | 0.8597 |
432 | 97T | 0.8596 |
433 | 3PO | 0.8594 |
434 | 0F9 | 0.8594 |
435 | 54Z | 0.8593 |
436 | OEG | 0.8593 |
437 | GWM | 0.8589 |
438 | NFA | 0.8581 |
439 | X1S | 0.8580 |
440 | SPA | 0.8579 |
441 | 1SA | 0.8574 |
442 | EYV | 0.8572 |
443 | 92P | 0.8567 |
444 | BRH | 0.8565 |
445 | 4JT | 0.8562 |
446 | RP5 | 0.8562 |
447 | LNO | 0.8562 |
448 | YRL | 0.8560 |
449 | NM2 | 0.8557 |
450 | EOL | 0.8549 |
451 | 94W | 0.8547 |
452 | AMG | 0.8538 |
453 | COI | 0.8536 |
454 | 9FE | 0.8525 |
455 | NM3 | 0.8511 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | AKG | 1.0000 |
2 | 2CO | 0.9906 |
3 | KMT | 0.9826 |
4 | MPJ | 0.9772 |
5 | LYN | 0.9729 |
6 | ONH | 0.9693 |
7 | LYS | 0.9645 |
8 | DLY | 0.9610 |
9 | 9ON | 0.9607 |
10 | OGA | 0.9594 |
11 | CSS | 0.9592 |
12 | S2G | 0.9571 |
13 | 7C3 | 0.9555 |
14 | 2IT | 0.9546 |
15 | GLN | 0.9528 |
16 | SLZ | 0.9527 |
17 | ASP | 0.9523 |
18 | HTX | 0.9512 |
19 | KQY | 0.9511 |
20 | SKJ | 0.9499 |
21 | ACA | 0.9485 |
22 | HL5 | 0.9482 |
23 | 69O | 0.9480 |
24 | DAV | 0.9461 |
25 | SHV | 0.9458 |
26 | NWH | 0.9450 |
27 | LMR | 0.9448 |
28 | 9X7 | 0.9448 |
29 | MLT | 0.9446 |
30 | 6XA | 0.9425 |
31 | 6NA | 0.9424 |
32 | ILE | 0.9417 |
33 | AL0 | 0.9416 |
34 | 2HG | 0.9410 |
35 | N6C | 0.9404 |
36 | HPN | 0.9394 |
37 | VAH | 0.9387 |
38 | PEL | 0.9385 |
39 | ASN | 0.9383 |
40 | MPH | 0.9372 |
41 | DHR | 0.9370 |
42 | LT1 | 0.9353 |
43 | MD0 | 0.9345 |
44 | 258 | 0.9342 |
45 | N4B | 0.9338 |
46 | NLP | 0.9337 |
47 | CXF | 0.9326 |
48 | 264 | 0.9324 |
49 | AG2 | 0.9324 |
50 | 8SZ | 0.9321 |
51 | 49F | 0.9320 |
52 | THE | 0.9320 |
53 | URQ | 0.9318 |
54 | 1KA | 0.9317 |
55 | 5XA | 0.9315 |
56 | VKC | 0.9314 |
57 | 268 | 0.9314 |
58 | OAA | 0.9312 |
59 | UGC | 0.9306 |
60 | COI | 0.9305 |
61 | CEE | 0.9305 |
62 | TLA | 0.9303 |
63 | 16D | 0.9303 |
64 | SGL | 0.9302 |
65 | FP1 | 0.9301 |
66 | SHO | 0.9294 |
67 | CUW | 0.9292 |
68 | 9YL | 0.9289 |
69 | OCT | 0.9289 |
70 | BNF | 0.9289 |
71 | NYL | 0.9288 |
72 | PG0 | 0.9287 |
73 | YRL | 0.9285 |
74 | PRA | 0.9284 |
75 | BHH | 0.9281 |
76 | DGN | 0.9279 |
77 | SKG | 0.9272 |
78 | TZE | 0.9272 |
79 | FAN | 0.9271 |
80 | TAR | 0.9268 |
81 | 2FT | 0.9267 |
82 | SD4 | 0.9264 |
83 | 98J | 0.9263 |
84 | I38 | 0.9260 |
85 | GUA | 0.9258 |
86 | ITN | 0.9253 |
87 | 3OL | 0.9252 |
88 | 3OM | 0.9252 |
89 | 717 | 0.9249 |
90 | ZBT | 0.9245 |
91 | 4JM | 0.9245 |
92 | HSM | 0.9241 |
93 | ZGL | 0.9237 |
94 | GOJ | 0.9235 |
95 | 0VT | 0.9231 |
96 | PEA | 0.9228 |
97 | PG3 | 0.9228 |
98 | O45 | 0.9222 |
99 | 2EH | 0.9221 |
100 | DIR | 0.9219 |
101 | SRT | 0.9215 |
102 | 8GL | 0.9215 |
103 | HGA | 0.9215 |
104 | HE4 | 0.9215 |
105 | JZ7 | 0.9213 |
106 | 40E | 0.9209 |
107 | Z82 | 0.9209 |
108 | 261 | 0.9205 |
109 | GLY ALA | 0.9197 |
110 | PNZ | 0.9195 |
111 | CRN | 0.9193 |
112 | 7OD | 0.9190 |
113 | I1E | 0.9188 |
114 | MSL | 0.9187 |
115 | 9YT | 0.9186 |
116 | AEF | 0.9184 |
117 | DYA | 0.9184 |
118 | 2RH | 0.9184 |
119 | NMH | 0.9184 |
120 | GLY GLY | 0.9183 |
121 | NTU | 0.9182 |
122 | DE5 | 0.9181 |
123 | 4SD | 0.9176 |
124 | AHB | 0.9173 |
125 | HY1 | 0.9171 |
126 | DAL DAL | 0.9170 |
127 | HC4 | 0.9170 |
128 | NIZ | 0.9170 |
129 | PAC | 0.9169 |
130 | 1SP | 0.9166 |
131 | BSX | 0.9165 |
132 | ISZ | 0.9162 |
133 | JYD | 0.9161 |
134 | JFJ | 0.9157 |
135 | PHB | 0.9154 |
136 | AJ3 | 0.9153 |
137 | MLE | 0.9152 |
138 | VAL | 0.9150 |
139 | FBM | 0.9150 |
140 | 51F | 0.9149 |
141 | GJZ | 0.9147 |
142 | FQI | 0.9146 |
143 | BHL | 0.9144 |
144 | 271 | 0.9143 |
145 | HZP | 0.9139 |
146 | NPO | 0.9137 |
147 | SEP | 0.9135 |
148 | 1DU | 0.9134 |
149 | SYM | 0.9134 |
150 | M3P | 0.9134 |
151 | TZL | 0.9131 |
152 | NF3 | 0.9130 |
153 | LER | 0.9128 |
154 | 2BG | 0.9127 |
155 | A8C | 0.9126 |
156 | LEA | 0.9124 |
157 | 2AS | 0.9123 |
158 | XYL | 0.9122 |
159 | FEH | 0.9121 |
160 | MXN | 0.9121 |
161 | 5XC | 0.9115 |
162 | PAB | 0.9115 |
163 | LDP | 0.9113 |
164 | RBL | 0.9112 |
165 | S8V | 0.9111 |
166 | HYA | 0.9110 |
167 | 4FA | 0.9108 |
168 | JZ4 | 0.9108 |
169 | 4MA | 0.9108 |
170 | 2LP | 0.9107 |
171 | AMH | 0.9107 |
172 | RBJ | 0.9106 |
173 | URP | 0.9105 |
174 | UY7 | 0.9103 |
175 | MHN | 0.9102 |
176 | LNO | 0.9101 |
177 | PEP | 0.9098 |
178 | YIV | 0.9097 |
179 | IXW | 0.9097 |
180 | R67 | 0.9096 |
181 | FOC | 0.9094 |
182 | TEO | 0.9091 |
183 | 3PG | 0.9088 |
184 | M4T | 0.9088 |
185 | PHU | 0.9086 |
186 | PBZ | 0.9083 |
187 | URO | 0.9080 |
188 | 4XR | 0.9080 |
189 | ALO | 0.9079 |
190 | 54D | 0.9077 |
191 | AC6 | 0.9076 |
192 | 3SS | 0.9076 |
193 | HPV | 0.9075 |
194 | SIN | 0.9075 |
195 | G3P | 0.9075 |
196 | 9J3 | 0.9074 |
197 | DPF | 0.9074 |
198 | BHO | 0.9073 |
199 | XBT | 0.9073 |
200 | RUJ | 0.9071 |
201 | Q07 | 0.9071 |
202 | RB5 | 0.9071 |
203 | BZ3 | 0.9071 |
204 | HBA | 0.9069 |
205 | SYN | 0.9068 |
206 | ABU | 0.9068 |
207 | 2PG | 0.9068 |
208 | PRY | 0.9067 |
209 | CFI | 0.9065 |
210 | 1DJ | 0.9064 |
211 | XUL | 0.9063 |
212 | PEQ | 0.9062 |
213 | HSO | 0.9061 |
214 | BPW | 0.9059 |
215 | GZ3 | 0.9059 |
216 | MNN | 0.9058 |
217 | QY9 | 0.9057 |
218 | MZW | 0.9057 |
219 | MLZ | 0.9054 |
220 | NXA | 0.9053 |
221 | XLS | 0.9051 |
222 | MRY | 0.9050 |
223 | 5OB | 0.9050 |
224 | KDG | 0.9049 |
225 | OPE | 0.9048 |
226 | KMH | 0.9047 |
227 | SSB | 0.9046 |
228 | AMC | 0.9046 |
229 | FUM | 0.9045 |
230 | OSE | 0.9044 |
231 | DHB | 0.9042 |
232 | R2B | 0.9042 |
233 | PZI | 0.9041 |
234 | 3LR | 0.9040 |
235 | HL4 | 0.9039 |
236 | TPA | 0.9038 |
237 | XM0 | 0.9038 |
238 | DGJ | 0.9037 |
239 | 7BC | 0.9036 |
240 | BEZ | 0.9036 |
241 | HDH | 0.9034 |
242 | DAS | 0.9032 |
243 | BEN | 0.9032 |
244 | NSD | 0.9031 |
245 | 6JN | 0.9030 |
246 | 0V5 | 0.9028 |
247 | H95 | 0.9028 |
248 | OKG | 0.9025 |
249 | SPV | 0.9024 |
250 | OEG | 0.9023 |
251 | OK7 | 0.9022 |
252 | KOJ | 0.9021 |
253 | 5FX | 0.9020 |
254 | THR | 0.9020 |
255 | 9X6 | 0.9019 |
256 | 4MV | 0.9017 |
257 | WTZ | 0.9016 |
258 | ALA ALA | 0.9016 |
259 | AE3 | 0.9016 |
260 | O8Y | 0.9013 |
261 | 7UC | 0.9013 |
262 | MEQ | 0.9011 |
263 | PBN | 0.9010 |
264 | 7A8 | 0.9010 |
265 | 259 | 0.9010 |
266 | AKB | 0.9007 |
267 | LDU | 0.9007 |
268 | XRG | 0.9006 |
269 | DZA | 0.9006 |
270 | FK8 | 0.9005 |
271 | HX3 | 0.9005 |
272 | T9G | 0.9002 |
273 | QDK | 0.9002 |
274 | HP6 | 0.9000 |
275 | DQY | 0.9000 |
276 | PO6 | 0.8998 |
277 | K6V | 0.8997 |
278 | 4NM | 0.8997 |
279 | IFL | 0.8996 |
280 | NOJ | 0.8996 |
281 | HE2 | 0.8995 |
282 | E5X | 0.8995 |
283 | 13P | 0.8992 |
284 | URS | 0.8989 |
285 | PBC | 0.8988 |
286 | BPN | 0.8986 |
287 | AHR | 0.8986 |
288 | ROR | 0.8986 |
289 | NMG | 0.8985 |
290 | FBJ | 0.8985 |
291 | 1Y6 | 0.8984 |
292 | PGA | 0.8984 |
293 | A20 | 0.8984 |
294 | TYL | 0.8983 |
295 | PPR | 0.8982 |
296 | I4B | 0.8981 |
297 | IHG | 0.8980 |
298 | MAE | 0.8979 |
299 | DMJ | 0.8979 |
300 | 3MV | 0.8979 |
301 | QFH | 0.8978 |
302 | HBD | 0.8978 |
303 | ANN | 0.8977 |
304 | 4HP | 0.8976 |
305 | DTU | 0.8976 |
306 | SR1 | 0.8976 |
307 | 650 | 0.8975 |
308 | J0Z | 0.8975 |
309 | YPN | 0.8974 |
310 | DMV | 0.8974 |
311 | NCA | 0.8974 |
312 | SHA | 0.8973 |
313 | 14J | 0.8972 |
314 | I2M | 0.8970 |
315 | ABN | 0.8969 |
316 | DCL | 0.8969 |
317 | 1AB | 0.8968 |
318 | F9P | 0.8967 |
319 | MUC | 0.8967 |
320 | 3H2 | 0.8967 |
321 | OOG | 0.8966 |
322 | MNM | 0.8965 |
323 | 2A9 | 0.8965 |
324 | 23B | 0.8964 |
325 | 4VP | 0.8964 |
326 | J9T | 0.8963 |
327 | 1SH | 0.8961 |
328 | 3HP | 0.8960 |
329 | RNT | 0.8959 |
330 | PYJ | 0.8959 |
331 | 7N0 | 0.8958 |
332 | 1LN | 0.8956 |
333 | IOM | 0.8955 |
334 | TCA | 0.8955 |
335 | IMR | 0.8955 |
336 | 263 | 0.8953 |
337 | 3HG | 0.8953 |
338 | NIO | 0.8953 |
339 | XIZ | 0.8952 |
340 | DE2 | 0.8949 |
341 | SER | 0.8949 |
342 | 5XB | 0.8948 |
343 | R1X | 0.8947 |
344 | FBA | 0.8947 |
345 | BAM | 0.8947 |
346 | NBZ | 0.8946 |
347 | 173 | 0.8946 |
348 | CIZ | 0.8946 |
349 | BR9 | 0.8946 |
350 | PYF | 0.8946 |
351 | AHN | 0.8943 |
352 | 9CL | 0.8943 |
353 | ZZ3 | 0.8940 |
354 | CXP | 0.8940 |
355 | TIH | 0.8940 |
356 | JB8 | 0.8936 |
357 | UNU | 0.8936 |
358 | FW5 | 0.8935 |
359 | KIV | 0.8935 |
360 | PZM | 0.8934 |
361 | H8N | 0.8933 |
362 | SSN | 0.8933 |
363 | 1PT | 0.8932 |
364 | EDG | 0.8930 |
365 | CMS | 0.8929 |
366 | NTN | 0.8928 |
367 | 6PC | 0.8927 |
368 | PBA | 0.8926 |
369 | MR1 | 0.8925 |
370 | LNR | 0.8924 |
371 | 4JL | 0.8923 |
372 | DHS | 0.8922 |
373 | TMH | 0.8922 |
374 | 7WG | 0.8921 |
375 | 42J | 0.8920 |
376 | HX2 | 0.8920 |
377 | OEM | 0.8918 |
378 | OTR | 0.8918 |
379 | 4JJ | 0.8917 |
380 | 0L1 | 0.8917 |
381 | Q9Z | 0.8917 |
382 | BP9 | 0.8916 |
383 | MWJ | 0.8915 |
384 | JND | 0.8915 |
385 | 2PC | 0.8913 |
386 | JDN | 0.8913 |
387 | PCA | 0.8913 |
388 | 1CO | 0.8913 |
389 | 2DR | 0.8911 |
390 | OCA | 0.8910 |
391 | 23W | 0.8908 |
392 | YCP | 0.8908 |
393 | SHF | 0.8907 |
394 | 9TY | 0.8906 |
395 | EHM | 0.8906 |
396 | NK2 | 0.8905 |
397 | 8EW | 0.8904 |
398 | RJY | 0.8903 |
399 | HIO | 0.8903 |
400 | 174 | 0.8903 |
401 | 6NT | 0.8902 |
402 | 826 | 0.8901 |
403 | XIY | 0.8899 |
404 | RSO | 0.8898 |
405 | 8WT | 0.8898 |
406 | GZL | 0.8896 |
407 | DTL | 0.8895 |
408 | HG3 | 0.8894 |
409 | 1M2 | 0.8893 |
410 | IZC | 0.8892 |
411 | 278 | 0.8890 |
412 | C2B | 0.8890 |
413 | GP9 | 0.8889 |
414 | JZ2 | 0.8889 |
415 | G4D | 0.8889 |
416 | HY3 | 0.8888 |
417 | HDA | 0.8888 |
418 | RAT | 0.8888 |
419 | F9Y | 0.8887 |
420 | 5JC | 0.8886 |
421 | Y8I | 0.8886 |
422 | VGL | 0.8885 |
423 | B40 | 0.8884 |
424 | TEG | 0.8879 |
425 | PGH | 0.8879 |
426 | TP5 | 0.8879 |
427 | AEG | 0.8877 |
428 | MZG | 0.8877 |
429 | 3SL | 0.8875 |
430 | 27Y | 0.8875 |
431 | HBX | 0.8875 |
432 | ABI | 0.8875 |
433 | KTA | 0.8875 |
434 | PZA | 0.8874 |
435 | NOY | 0.8874 |
436 | RIB | 0.8874 |
437 | IF7 | 0.8873 |
438 | DXX | 0.8872 |
439 | IQ0 | 0.8872 |
440 | DHY | 0.8871 |
441 | 269 | 0.8871 |
442 | 0HN | 0.8871 |
443 | HCI | 0.8871 |
444 | SS2 | 0.8870 |
445 | LTL | 0.8869 |
446 | INO | 0.8869 |
447 | SMB | 0.8868 |
448 | EV0 | 0.8868 |
449 | XSP | 0.8868 |
450 | APY | 0.8867 |
451 | 2HO | 0.8867 |
452 | CCU | 0.8866 |
453 | MZT | 0.8865 |
454 | PAF | 0.8863 |
455 | BUB | 0.8863 |
456 | 1SA | 0.8861 |
457 | B2J | 0.8861 |
458 | 4NC | 0.8860 |
459 | 4P5 | 0.8860 |
460 | DPJ | 0.8858 |
461 | 449 | 0.8858 |
462 | 2KT | 0.8856 |
463 | 8EZ | 0.8856 |
464 | P72 | 0.8856 |
465 | 93K | 0.8855 |
466 | AC5 | 0.8854 |
467 | PHE | 0.8854 |
468 | PSJ | 0.8853 |
469 | NBE | 0.8853 |
470 | CHB | 0.8852 |
471 | M6W | 0.8851 |
472 | HYP | 0.8849 |
473 | 3A9 | 0.8849 |
474 | PKU | 0.8849 |
475 | M58 | 0.8849 |
476 | 4M4 | 0.8848 |
477 | EUG | 0.8848 |
478 | CHH | 0.8848 |
479 | MEV | 0.8848 |
480 | MLA | 0.8846 |
481 | G3H | 0.8845 |
482 | 9TW | 0.8845 |
483 | QMP | 0.8844 |
484 | 1F1 | 0.8844 |
485 | JLZ | 0.8843 |
486 | B24 | 0.8842 |
487 | 5HY | 0.8840 |
488 | OHG | 0.8840 |
489 | COM | 0.8839 |
490 | P9P | 0.8838 |
491 | J9N | 0.8838 |
492 | QSC | 0.8837 |
493 | 3QM | 0.8836 |
494 | BNS | 0.8836 |
495 | ODV | 0.8836 |
496 | SVJ | 0.8834 |
497 | JZ5 | 0.8834 |
498 | FHB | 0.8834 |
499 | 4ZA | 0.8833 |
500 | Z6J | 0.8832 |
501 | OC9 | 0.8829 |
502 | FCN | 0.8828 |
503 | 069 | 0.8828 |
504 | 192 | 0.8828 |
505 | FPI | 0.8827 |
506 | LFC | 0.8826 |
507 | F06 | 0.8825 |
508 | 2ZM | 0.8825 |
509 | 2AL | 0.8824 |
510 | F4E | 0.8824 |
511 | 5AC | 0.8822 |
512 | 4WL | 0.8820 |
513 | NNO | 0.8820 |
514 | XYD | 0.8820 |
515 | MRZ | 0.8819 |
516 | HIS | 0.8819 |
517 | SYG | 0.8819 |
518 | LLQ | 0.8819 |
519 | HHI | 0.8818 |
520 | X1S | 0.8818 |
521 | 282 | 0.8818 |
522 | 3NY | 0.8817 |
523 | 4A3 | 0.8816 |
524 | AT3 | 0.8815 |
525 | 3OC | 0.8814 |
526 | IP8 | 0.8813 |
527 | PY7 | 0.8813 |
528 | 2XX | 0.8813 |
529 | PLU | 0.8812 |
530 | K34 | 0.8812 |
531 | 32O | 0.8812 |
532 | 4LR | 0.8812 |
533 | 53C | 0.8811 |
534 | K6H | 0.8810 |
535 | FUD | 0.8809 |
536 | ETM | 0.8809 |
537 | 8X3 | 0.8808 |
538 | MLI | 0.8808 |
539 | HUI | 0.8808 |
540 | SPD | 0.8808 |
541 | GIF | 0.8806 |
542 | MCT | 0.8806 |
543 | KPL | 0.8805 |
544 | 1MR | 0.8804 |
545 | 4CL | 0.8803 |
546 | 9SE | 0.8800 |
547 | AX3 | 0.8800 |
548 | PRO | 0.8800 |
549 | 2HU | 0.8799 |
550 | SMN | 0.8799 |
551 | IFM | 0.8798 |
552 | RNS | 0.8797 |
553 | SNE | 0.8796 |
554 | 129 | 0.8796 |
555 | V55 | 0.8796 |
556 | 3HM | 0.8795 |
557 | ICN | 0.8795 |
558 | NM2 | 0.8795 |
559 | NM3 | 0.8795 |
560 | M45 | 0.8794 |
561 | OHP | 0.8794 |
562 | IHB | 0.8794 |
563 | 34V | 0.8794 |
564 | PAH | 0.8793 |
565 | QBM | 0.8793 |
566 | 4CS | 0.8793 |
567 | SC2 | 0.8792 |
568 | BUA | 0.8792 |
569 | HGQ | 0.8792 |
570 | TYE | 0.8791 |
571 | 6NI | 0.8791 |
572 | 3YP | 0.8790 |
573 | 1GP | 0.8789 |
574 | 3PP | 0.8789 |
575 | DHI | 0.8789 |
576 | JZ3 | 0.8789 |
577 | PYD | 0.8788 |
578 | 5NI | 0.8788 |
579 | RMN | 0.8785 |
580 | L99 | 0.8784 |
581 | DSN | 0.8784 |
582 | 8ZE | 0.8784 |
583 | DHK | 0.8783 |
584 | 92K | 0.8781 |
585 | ICF | 0.8781 |
586 | 3S5 | 0.8781 |
587 | UYA | 0.8780 |
588 | EFS | 0.8780 |
589 | P2D | 0.8780 |
590 | BML | 0.8780 |
591 | 9SB | 0.8779 |
592 | GPJ | 0.8778 |
593 | GPF | 0.8778 |
594 | SOL | 0.8777 |
595 | XX2 | 0.8776 |
596 | ORO | 0.8775 |
597 | QSB | 0.8772 |
598 | 2HC | 0.8772 |
599 | CCD | 0.8772 |
600 | AOS | 0.8771 |
601 | SHI | 0.8771 |
602 | FRU | 0.8771 |
603 | FPK | 0.8770 |
604 | SS1 | 0.8767 |
605 | R9S | 0.8766 |
606 | CYX | 0.8766 |
607 | 45L | 0.8765 |
608 | XBZ | 0.8765 |
609 | P7Y | 0.8764 |
610 | 4CH | 0.8763 |
611 | DEE | 0.8763 |
612 | ACH | 0.8763 |
613 | EOU | 0.8763 |
614 | 0HO | 0.8762 |
615 | PRS | 0.8761 |
616 | S76 | 0.8761 |
617 | MT2 | 0.8761 |
618 | OXZ | 0.8759 |
619 | 41K | 0.8758 |
620 | AAE | 0.8757 |
621 | ASC | 0.8756 |
622 | 3MB | 0.8755 |
623 | 60P | 0.8754 |
624 | AS3 | 0.8754 |
625 | SOR | 0.8754 |
626 | RTK | 0.8754 |
627 | GLO | 0.8753 |
628 | PRI | 0.8753 |
629 | GAB | 0.8753 |
630 | OVM | 0.8752 |
631 | TFB | 0.8752 |
632 | B85 | 0.8750 |
633 | RIP | 0.8750 |
634 | TIU | 0.8749 |
635 | VPR | 0.8748 |
636 | S2P | 0.8748 |
637 | 7MU | 0.8748 |
638 | GRO | 0.8746 |
639 | 2D8 | 0.8746 |
640 | H76 | 0.8745 |
641 | 3XX | 0.8745 |
642 | 3AL | 0.8744 |
643 | GG6 | 0.8743 |
644 | ABV | 0.8743 |
645 | MYJ | 0.8742 |
646 | AC0 | 0.8740 |
647 | OVP | 0.8740 |
648 | AGK | 0.8739 |
649 | 2FG | 0.8738 |
650 | 3ZQ | 0.8738 |
651 | GLL | 0.8738 |
652 | N2I | 0.8737 |
653 | 8NY | 0.8737 |
654 | GLA | 0.8736 |
655 | FSG | 0.8736 |
656 | 1P8 | 0.8736 |
657 | TPO | 0.8735 |
658 | URF | 0.8734 |
659 | A5E | 0.8733 |
660 | 64K | 0.8733 |
661 | TAG | 0.8731 |
662 | TNE | 0.8731 |
663 | 3PY | 0.8731 |
664 | HT4 | 0.8729 |
665 | PDC | 0.8729 |
666 | ES2 | 0.8727 |
667 | AMS | 0.8727 |
668 | H7Y | 0.8726 |
669 | 1P3 | 0.8725 |
670 | 2AC | 0.8725 |
671 | 97T | 0.8724 |
672 | ICP | 0.8724 |
673 | LYL | 0.8724 |
674 | RUU | 0.8724 |
675 | LUQ | 0.8723 |
676 | 3AB | 0.8723 |
677 | PUT | 0.8722 |
678 | 11S | 0.8721 |
679 | 3V4 | 0.8721 |
680 | KG7 | 0.8719 |
681 | C2A | 0.8719 |
682 | PD2 | 0.8718 |
683 | PCT | 0.8718 |
684 | DFU | 0.8718 |
685 | GAL | 0.8716 |
686 | IVA | 0.8715 |
687 | SAN | 0.8715 |
688 | BVC | 0.8715 |
689 | HVQ | 0.8715 |
690 | 2A7 | 0.8714 |
691 | O7U | 0.8714 |
692 | RSF | 0.8714 |
693 | ARB | 0.8713 |
694 | JZ1 | 0.8712 |
695 | BXO | 0.8712 |
696 | ES9 | 0.8712 |
697 | 3C4 | 0.8711 |
698 | TYR | 0.8711 |
699 | FLA | 0.8710 |
700 | 3HB | 0.8710 |
701 | 9RW | 0.8709 |
702 | 0OC | 0.8709 |
703 | IT2 | 0.8709 |
704 | D1X | 0.8708 |
705 | PSE | 0.8705 |
706 | OVV | 0.8705 |
707 | TB6 | 0.8703 |
708 | 149 | 0.8702 |
709 | BAE | 0.8702 |
710 | DMG | 0.8701 |
711 | NK1 | 0.8699 |
712 | 273 | 0.8697 |
713 | P81 | 0.8694 |
714 | SKM | 0.8694 |
715 | 2RA | 0.8693 |
716 | 4J8 | 0.8693 |
717 | IOL | 0.8691 |
718 | QOS | 0.8690 |
719 | IDH | 0.8690 |
720 | 8OZ | 0.8690 |
721 | E4P | 0.8690 |
722 | MAN | 0.8688 |
723 | R8A | 0.8687 |
724 | 4DX | 0.8687 |
725 | 2MH | 0.8686 |
726 | CCE | 0.8686 |
727 | R2P | 0.8685 |
728 | T6C | 0.8684 |
729 | ES6 | 0.8683 |
730 | 23A | 0.8682 |
731 | 2BX | 0.8682 |
732 | VNJ | 0.8681 |
733 | 0R0 | 0.8681 |
734 | DYT | 0.8681 |
735 | DTT | 0.8680 |
736 | TH7 | 0.8680 |
737 | WBU | 0.8679 |
738 | RM1 | 0.8678 |
739 | OW4 | 0.8675 |
740 | ESP | 0.8674 |
741 | AEH | 0.8673 |
742 | POA | 0.8673 |
743 | 1A7 | 0.8669 |
744 | GDE | 0.8669 |
745 | 4XV | 0.8668 |
746 | SYC | 0.8668 |
747 | 24B | 0.8667 |
748 | KP6 | 0.8666 |
749 | 2FY | 0.8666 |
750 | MTL | 0.8664 |
751 | 3BZ | 0.8663 |
752 | 4HO | 0.8661 |
753 | FOM | 0.8660 |
754 | AX7 | 0.8660 |
755 | TDR | 0.8660 |
756 | BZ2 | 0.8658 |
757 | TBP | 0.8657 |
758 | 1MC | 0.8656 |
759 | ZZT | 0.8655 |
760 | HPP | 0.8655 |
761 | IP0 | 0.8652 |
762 | AZF | 0.8651 |
763 | S24 | 0.8651 |
764 | 5MH | 0.8650 |
765 | MZ0 | 0.8650 |
766 | X6X | 0.8648 |
767 | 2YU | 0.8648 |
768 | 0MK | 0.8646 |
769 | AAS | 0.8645 |
770 | FUB | 0.8643 |
771 | XCZ | 0.8643 |
772 | CP | 0.8642 |
773 | DGY | 0.8640 |
774 | PMF | 0.8640 |
775 | J9Q | 0.8640 |
776 | G2H | 0.8638 |
777 | VNL | 0.8637 |
778 | MTG | 0.8637 |
779 | HDL | 0.8637 |
780 | DFB | 0.8637 |
781 | HPS | 0.8635 |
782 | 4TB | 0.8635 |
783 | GYE | 0.8634 |
784 | 7VD | 0.8634 |
785 | NVI | 0.8634 |
786 | 3NT | 0.8633 |
787 | FPY | 0.8633 |
788 | MPD | 0.8632 |
789 | 286 | 0.8631 |
790 | PTO | 0.8630 |
791 | HMH | 0.8630 |
792 | IPU | 0.8629 |
793 | DBH | 0.8626 |
794 | 6FZ | 0.8625 |
795 | MAK | 0.8624 |
796 | ARG | 0.8623 |
797 | 152 | 0.8622 |
798 | MAH | 0.8622 |
799 | ESX | 0.8621 |
800 | PPY | 0.8620 |
801 | P92 | 0.8620 |
802 | NSP | 0.8620 |
803 | I3A | 0.8620 |
804 | N9J | 0.8619 |
805 | 4SX | 0.8619 |
806 | PRZ | 0.8619 |
807 | NK | 0.8619 |
808 | R9M | 0.8616 |
809 | FBS | 0.8615 |
810 | A3B | 0.8615 |
811 | APG | 0.8615 |
812 | 4XS | 0.8614 |
813 | 43M | 0.8613 |
814 | TAU | 0.8613 |
815 | MSR | 0.8612 |
816 | P80 | 0.8611 |
817 | 2MP | 0.8610 |
818 | 5MB | 0.8608 |
819 | HIU | 0.8600 |
820 | DOR | 0.8599 |
821 | PIY | 0.8599 |
822 | 03W | 0.8599 |
823 | 8GC | 0.8596 |
824 | EKZ | 0.8596 |
825 | 4HS | 0.8596 |
826 | FUC | 0.8596 |
827 | FUF | 0.8594 |
828 | GAF | 0.8594 |
829 | ABE | 0.8592 |
830 | G8M | 0.8592 |
831 | A09 | 0.8591 |
832 | CHT | 0.8590 |
833 | 34A | 0.8590 |
834 | 4JU | 0.8588 |
835 | 284 | 0.8586 |
836 | 4JN | 0.8585 |
837 | JAW | 0.8584 |
838 | ZXD | 0.8581 |
839 | GLC | 0.8581 |
840 | 8WO | 0.8581 |
841 | TM7 | 0.8580 |
842 | MLM | 0.8580 |
843 | 5NU | 0.8579 |
844 | 2EZ | 0.8575 |
845 | 2D0 | 0.8575 |
846 | 911 | 0.8575 |
847 | BGC | 0.8573 |
848 | B3U | 0.8571 |
849 | 4ZE | 0.8570 |
850 | OXC | 0.8569 |
851 | TSS | 0.8568 |
852 | SAT | 0.8568 |
853 | MPV | 0.8566 |
854 | TFU | 0.8565 |
855 | XQG | 0.8565 |
856 | HMU | 0.8564 |
857 | FBW | 0.8560 |
858 | PEZ | 0.8559 |
859 | PBE | 0.8558 |
860 | 7MH | 0.8555 |
861 | 61M | 0.8550 |
862 | 54G | 0.8544 |
863 | CWM | 0.8544 |
864 | PC | 0.8541 |
865 | S0H | 0.8533 |
866 | ILO | 0.8531 |
867 | MS9 | 0.8527 |
868 | XYS | 0.8513 |
This union binding pocket(no: 1) in the query (biounit: 4jyd.bio1) has 33 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |