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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|
No: | Ligand | Similarity coefficient |
---|---|---|
1 | GLY ALA | 1.0000 |
2 | XRG | 0.9552 |
3 | IHG | 0.9538 |
4 | BHH | 0.9536 |
5 | K6V | 0.9504 |
6 | DTL | 0.9492 |
7 | GLY CYS | 0.9477 |
8 | HDA | 0.9464 |
9 | XYL | 0.9457 |
10 | TZL | 0.9455 |
11 | MRY | 0.9418 |
12 | FBJ | 0.9407 |
13 | RB5 | 0.9402 |
14 | RB0 | 0.9402 |
15 | LMR | 0.9383 |
16 | 5XA | 0.9382 |
17 | HL5 | 0.9380 |
18 | XLS | 0.9371 |
19 | MXN | 0.9370 |
20 | SD4 | 0.9369 |
21 | AL0 | 0.9366 |
22 | XBT | 0.9347 |
23 | 54D | 0.9342 |
24 | MLT | 0.9329 |
25 | GLY GLY | 0.9321 |
26 | OAA | 0.9319 |
27 | 2EH | 0.9312 |
28 | IOM | 0.9281 |
29 | SIN | 0.9274 |
30 | 3HL | 0.9273 |
31 | CFI | 0.9271 |
32 | MNN | 0.9269 |
33 | CRN | 0.9256 |
34 | I1E | 0.9252 |
35 | 1DJ | 0.9249 |
36 | MLI | 0.9247 |
37 | PZI | 0.9246 |
38 | DAS | 0.9240 |
39 | PAH | 0.9233 |
40 | PEP | 0.9228 |
41 | OGA | 0.9228 |
42 | GLU | 0.9225 |
43 | 23W | 0.9220 |
44 | RNS | 0.9215 |
45 | BHO | 0.9213 |
46 | PKU | 0.9202 |
47 | F9P | 0.9202 |
48 | MET | 0.9197 |
49 | MLA | 0.9196 |
50 | OTR | 0.9195 |
51 | LEU | 0.9191 |
52 | ASP | 0.9191 |
53 | PEL | 0.9188 |
54 | ISZ | 0.9181 |
55 | MUC | 0.9181 |
56 | HDH | 0.9178 |
57 | LER | 0.9168 |
58 | NIZ | 0.9167 |
59 | COI | 0.9167 |
60 | HZP | 0.9166 |
61 | TLA | 0.9165 |
62 | ZBT | 0.9160 |
63 | HY1 | 0.9155 |
64 | LLQ | 0.9153 |
65 | 4SD | 0.9149 |
66 | 3HR | 0.9149 |
67 | ILE | 0.9148 |
68 | TZE | 0.9145 |
69 | FEH | 0.9145 |
70 | MZW | 0.9144 |
71 | 49F | 0.9143 |
72 | DGN | 0.9142 |
73 | HSM | 0.9137 |
74 | HX2 | 0.9137 |
75 | KOJ | 0.9134 |
76 | RJY | 0.9132 |
77 | 1SP | 0.9132 |
78 | CMS | 0.9129 |
79 | IPU | 0.9128 |
80 | ALA ALA | 0.9124 |
81 | 3OM | 0.9117 |
82 | MED | 0.9117 |
83 | RBL | 0.9116 |
84 | FUM | 0.9115 |
85 | HCS | 0.9115 |
86 | HYA | 0.9112 |
87 | XUL | 0.9109 |
88 | IVA | 0.9107 |
89 | PG0 | 0.9105 |
90 | AKG | 0.9100 |
91 | SYM | 0.9098 |
92 | PRO | 0.9097 |
93 | FBM | 0.9095 |
94 | PEA | 0.9094 |
95 | 6PC | 0.9094 |
96 | ORN | 0.9093 |
97 | DCL | 0.9090 |
98 | 9YL | 0.9083 |
99 | 8OZ | 0.9082 |
100 | 6NA | 0.9081 |
101 | ROR | 0.9080 |
102 | TEO | 0.9080 |
103 | IXW | 0.9079 |
104 | TFB | 0.9078 |
105 | DYA | 0.9078 |
106 | OEM | 0.9076 |
107 | NXA | 0.9075 |
108 | DAV | 0.9074 |
109 | GJZ | 0.9072 |
110 | PRS | 0.9068 |
111 | 4CS | 0.9066 |
112 | BP9 | 0.9064 |
113 | CXF | 0.9063 |
114 | GLN | 0.9063 |
115 | ABU | 0.9060 |
116 | VKC | 0.9060 |
117 | XM0 | 0.9058 |
118 | AMC | 0.9057 |
119 | ITN | 0.9052 |
120 | JZ5 | 0.9051 |
121 | ABN | 0.9050 |
122 | 2HG | 0.9050 |
123 | 7WG | 0.9050 |
124 | DTT | 0.9048 |
125 | DMG | 0.9048 |
126 | MAE | 0.9048 |
127 | 3OL | 0.9041 |
128 | JYD | 0.9040 |
129 | FW5 | 0.9040 |
130 | 3HB | 0.9039 |
131 | ASN | 0.9036 |
132 | SSN | 0.9035 |
133 | 1SA | 0.9035 |
134 | QY9 | 0.9035 |
135 | AAE | 0.9035 |
136 | 45L | 0.9030 |
137 | GUA | 0.9029 |
138 | OEG | 0.9028 |
139 | SRT | 0.9027 |
140 | OKG | 0.9024 |
141 | PAE | 0.9022 |
142 | CP | 0.9021 |
143 | DTU | 0.9020 |
144 | 2RH | 0.9020 |
145 | SMV | 0.9019 |
146 | PCA | 0.9018 |
147 | HTX | 0.9016 |
148 | 4MV | 0.9015 |
149 | FQI | 0.9010 |
150 | 2PC | 0.9009 |
151 | THE | 0.9006 |
152 | MEQ | 0.9005 |
153 | PYJ | 0.9003 |
154 | GP9 | 0.9003 |
155 | SYN | 0.9002 |
156 | QDK | 0.9001 |
157 | B24 | 0.9001 |
158 | GGL | 0.8998 |
159 | 40E | 0.8997 |
160 | RSO | 0.8996 |
161 | 2CO | 0.8996 |
162 | OPE | 0.8994 |
163 | GOJ | 0.8992 |
164 | O8Y | 0.8992 |
165 | SGL | 0.8992 |
166 | PYC | 0.8986 |
167 | TZC | 0.8985 |
168 | DE5 | 0.8985 |
169 | 3OC | 0.8985 |
170 | 173 | 0.8984 |
171 | LYS | 0.8984 |
172 | FOC | 0.8982 |
173 | 268 | 0.8982 |
174 | 271 | 0.8978 |
175 | S0H | 0.8978 |
176 | 7VD | 0.8978 |
177 | M58 | 0.8977 |
178 | 13P | 0.8977 |
179 | CEE | 0.8974 |
180 | 7N0 | 0.8974 |
181 | 3BU | 0.8973 |
182 | BEZ | 0.8971 |
183 | BNS | 0.8970 |
184 | 3NT | 0.8969 |
185 | G3P | 0.8969 |
186 | G3H | 0.8969 |
187 | UYA | 0.8967 |
188 | RNT | 0.8967 |
189 | 3MV | 0.8965 |
190 | TPA | 0.8965 |
191 | 3SL | 0.8964 |
192 | C2A | 0.8961 |
193 | NTU | 0.8960 |
194 | HSO | 0.8960 |
195 | 717 | 0.8960 |
196 | 9X7 | 0.8956 |
197 | 5FX | 0.8955 |
198 | VAH | 0.8955 |
199 | H95 | 0.8954 |
200 | NIO | 0.8954 |
201 | DGL | 0.8951 |
202 | HSE | 0.8951 |
203 | PGA | 0.8951 |
204 | SC2 | 0.8949 |
205 | NCA | 0.8948 |
206 | BAM | 0.8946 |
207 | BEN | 0.8946 |
208 | YRL | 0.8943 |
209 | 1GP | 0.8943 |
210 | P2D | 0.8942 |
211 | PAC | 0.8941 |
212 | 53C | 0.8940 |
213 | IZC | 0.8940 |
214 | HIS | 0.8938 |
215 | 0V5 | 0.8937 |
216 | TAR | 0.8937 |
217 | 7BC | 0.8936 |
218 | K34 | 0.8936 |
219 | PG3 | 0.8936 |
220 | SMN | 0.8934 |
221 | 3LR | 0.8933 |
222 | 7MU | 0.8933 |
223 | AOS | 0.8933 |
224 | RMN | 0.8932 |
225 | PBC | 0.8931 |
226 | 98J | 0.8930 |
227 | CYS | 0.8930 |
228 | 9J3 | 0.8927 |
229 | SHF | 0.8927 |
230 | MPD | 0.8925 |
231 | EHM | 0.8924 |
232 | 1DV | 0.8923 |
233 | JBN | 0.8919 |
234 | SNE | 0.8917 |
235 | SHO | 0.8915 |
236 | DSN | 0.8913 |
237 | PRA | 0.8909 |
238 | 2IT | 0.8908 |
239 | DBB | 0.8908 |
240 | KMT | 0.8906 |
241 | PEQ | 0.8904 |
242 | URP | 0.8901 |
243 | AHB | 0.8900 |
244 | PMB | 0.8899 |
245 | NLE | 0.8898 |
246 | 263 | 0.8897 |
247 | OHG | 0.8896 |
248 | AEF | 0.8896 |
249 | 2AL | 0.8896 |
250 | HE2 | 0.8894 |
251 | PZA | 0.8893 |
252 | G2H | 0.8891 |
253 | SS1 | 0.8885 |
254 | YCP | 0.8885 |
255 | DAL DAL | 0.8881 |
256 | SOR | 0.8880 |
257 | NMH | 0.8878 |
258 | FB2 | 0.8874 |
259 | GRO | 0.8874 |
260 | 258 | 0.8873 |
261 | NYL | 0.8869 |
262 | JZ7 | 0.8869 |
263 | N4B | 0.8866 |
264 | GLL | 0.8865 |
265 | A09 | 0.8864 |
266 | 1H1 | 0.8863 |
267 | NMG | 0.8861 |
268 | 2FT | 0.8859 |
269 | OCT | 0.8858 |
270 | QSC | 0.8858 |
271 | 3PG | 0.8857 |
272 | URQ | 0.8856 |
273 | DLY | 0.8851 |
274 | MEV | 0.8851 |
275 | 264 | 0.8847 |
276 | SPV | 0.8846 |
277 | BNF | 0.8846 |
278 | YIV | 0.8844 |
279 | 1DU | 0.8844 |
280 | MD0 | 0.8844 |
281 | PGH | 0.8843 |
282 | 7C3 | 0.8840 |
283 | AG2 | 0.8839 |
284 | APG | 0.8839 |
285 | UNU | 0.8837 |
286 | 4XR | 0.8834 |
287 | KIV | 0.8834 |
288 | LEA | 0.8826 |
289 | 069 | 0.8823 |
290 | DHR | 0.8823 |
291 | 269 | 0.8821 |
292 | PPV | 0.8821 |
293 | 9RW | 0.8813 |
294 | TB6 | 0.8809 |
295 | FUD | 0.8806 |
296 | HIO | 0.8800 |
297 | DXX | 0.8796 |
298 | I4B | 0.8795 |
299 | X1S | 0.8795 |
300 | 1KA | 0.8793 |
301 | 9ON | 0.8791 |
302 | PCT | 0.8790 |
303 | IT2 | 0.8787 |
304 | 69O | 0.8787 |
305 | K6H | 0.8785 |
306 | A20 | 0.8785 |
307 | SPA | 0.8781 |
308 | UY7 | 0.8781 |
309 | GZ3 | 0.8778 |
310 | SHV | 0.8775 |
311 | 42J | 0.8775 |
312 | MRZ | 0.8775 |
313 | 2PG | 0.8773 |
314 | HYP | 0.8771 |
315 | B40 | 0.8771 |
316 | HE4 | 0.8767 |
317 | LT1 | 0.8767 |
318 | 0VT | 0.8766 |
319 | TIH | 0.8765 |
320 | 129 | 0.8762 |
321 | 4JL | 0.8761 |
322 | MLE | 0.8760 |
323 | N6C | 0.8760 |
324 | 4FA | 0.8754 |
325 | ONL | 0.8753 |
326 | M6W | 0.8752 |
327 | BXO | 0.8746 |
328 | NVA | 0.8742 |
329 | DHS | 0.8741 |
330 | PSJ | 0.8741 |
331 | KDG | 0.8740 |
332 | URS | 0.8739 |
333 | LNO | 0.8737 |
334 | XCZ | 0.8736 |
335 | NCT | 0.8734 |
336 | KMH | 0.8727 |
337 | PIS | 0.8725 |
338 | AFS | 0.8725 |
339 | 16D | 0.8725 |
340 | PJL | 0.8723 |
341 | OOG | 0.8723 |
342 | ACA | 0.8717 |
343 | RBJ | 0.8715 |
344 | 6JN | 0.8715 |
345 | LPK | 0.8714 |
346 | BHL | 0.8713 |
347 | PPR | 0.8705 |
348 | 1CO | 0.8701 |
349 | LDP | 0.8694 |
350 | S2G | 0.8692 |
351 | 2DR | 0.8692 |
352 | LTL | 0.8688 |
353 | 1SH | 0.8688 |
354 | FK8 | 0.8687 |
355 | QMP | 0.8686 |
356 | AC0 | 0.8683 |
357 | PLU | 0.8682 |
358 | 2PN | 0.8672 |
359 | SAT | 0.8670 |
360 | 3SS | 0.8665 |
361 | SHI | 0.8663 |
362 | ACH | 0.8662 |
363 | AE3 | 0.8660 |
364 | S2P | 0.8658 |
365 | GLO | 0.8658 |
366 | HCI | 0.8656 |
367 | KTA | 0.8653 |
368 | JAB | 0.8648 |
369 | ICF | 0.8644 |
370 | ASC | 0.8642 |
371 | A8C | 0.8632 |
372 | R2P | 0.8630 |
373 | LFC | 0.8629 |
374 | FBW | 0.8625 |
375 | I38 | 0.8624 |
376 | HIC | 0.8617 |
377 | FBA | 0.8616 |
378 | URO | 0.8606 |
379 | CXP | 0.8602 |
380 | PZM | 0.8600 |
381 | AT3 | 0.8594 |
382 | HGA | 0.8584 |
383 | B3U | 0.8584 |
384 | P22 | 0.8582 |
385 | A3M | 0.8580 |
386 | KPL | 0.8571 |
387 | HMH | 0.8564 |
388 | 9X6 | 0.8553 |
389 | HG3 | 0.8541 |
390 | O45 | 0.8537 |