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- Structure Biounit | Ligand Information
- 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 1331 families. | |||||
1 | 3R95 | - | ACO | C23 H38 N7 O17 P3 S | CC(=O)SCCN.... |
2 | 3R9E | - | DSZ | C14 H19 N7 O9 S | c1nc(c2c(n.... |
3 | 3R9G | - | COA | C21 H36 N7 O16 P3 S | CC(C)(CO[P.... |
4 | 3R9F | - | GSU | C15 H21 N7 O9 S | c1nc(c2c(n.... |
5 | 3R96 | Kd = 1.03 mM | AMP | C10 H14 N5 O7 P | c1nc(c2c(n.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 34 families. | |||||
1 | 3R95 | - | ACO | C23 H38 N7 O17 P3 S | CC(=O)SCCN.... |
2 | 3R9E | - | DSZ | C14 H19 N7 O9 S | c1nc(c2c(n.... |
3 | 3R9G | - | COA | C21 H36 N7 O16 P3 S | CC(C)(CO[P.... |
4 | 3R9F | - | GSU | C15 H21 N7 O9 S | c1nc(c2c(n.... |
5 | 3R96 | Kd = 1.03 mM | AMP | C10 H14 N5 O7 P | c1nc(c2c(n.... |
6 | 1S7N | - | COA | C21 H36 N7 O16 P3 S | CC(C)(CO[P.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 7MC | 1 | 1 |
2 | 7MD | 0.771429 | 0.975309 |
3 | V2G | 0.550459 | 0.914634 |
4 | XAH | 0.537815 | 0.904762 |
5 | AMO | 0.535088 | 0.901235 |
6 | AMP | 0.534653 | 0.817073 |
7 | A | 0.534653 | 0.817073 |
8 | 45A | 0.533981 | 0.819277 |
9 | ABM | 0.533981 | 0.819277 |
10 | KG4 | 0.53271 | 0.865854 |
11 | QA7 | 0.530973 | 0.845238 |
12 | TXA | 0.529915 | 0.878049 |
13 | AMP MG | 0.529412 | 0.804878 |
14 | CA0 | 0.523364 | 0.865854 |
15 | 5AL | 0.522523 | 0.876543 |
16 | WAQ | 0.521368 | 0.902439 |
17 | LAD | 0.521368 | 0.926829 |
18 | A2D | 0.519231 | 0.841463 |
19 | B4P | 0.518868 | 0.841463 |
20 | AP5 | 0.518868 | 0.841463 |
21 | ADP | 0.518868 | 0.841463 |
22 | 8LQ | 0.517544 | 0.878049 |
23 | 1ZZ | 0.516949 | 0.882353 |
24 | ADP BEF | 0.514019 | 0.817073 |
25 | ADP MG | 0.514019 | 0.817073 |
26 | PRX | 0.513761 | 0.843373 |
27 | ANP | 0.513514 | 0.843373 |
28 | 8LH | 0.513274 | 0.878049 |
29 | 9ZD | 0.513043 | 0.857143 |
30 | 9ZA | 0.513043 | 0.857143 |
31 | MYR AMP | 0.512605 | 0.860465 |
32 | BA3 | 0.509434 | 0.841463 |
33 | A12 | 0.509434 | 0.833333 |
34 | AP2 | 0.509434 | 0.833333 |
35 | AU1 | 0.509259 | 0.843373 |
36 | M33 | 0.509259 | 0.853659 |
37 | APC MG | 0.509091 | 0.797619 |
38 | 8LE | 0.508929 | 0.845238 |
39 | DSZ | 0.508621 | 0.802198 |
40 | HEJ | 0.504587 | 0.841463 |
41 | ATP | 0.504587 | 0.841463 |
42 | DAL AMP | 0.504348 | 0.853659 |
43 | AHX | 0.504274 | 0.891566 |
44 | NB8 | 0.504202 | 0.891566 |
45 | GAP | 0.5 | 0.865854 |
46 | ACQ | 0.5 | 0.843373 |
47 | 5FA | 0.5 | 0.841463 |
48 | APC | 0.5 | 0.833333 |
49 | AQP | 0.5 | 0.841463 |
50 | 8QN | 0.5 | 0.876543 |
51 | SON | 0.5 | 0.855422 |
52 | AT4 | 0.5 | 0.811765 |
53 | AN2 | 0.5 | 0.853659 |
54 | SRA | 0.5 | 0.77907 |
55 | SRP | 0.5 | 0.901235 |
56 | 5SV | 0.5 | 0.847059 |
57 | 4AD | 0.495726 | 0.890244 |
58 | PAJ | 0.495726 | 0.858824 |
59 | ADP PO3 | 0.495495 | 0.817073 |
60 | ATP MG | 0.495495 | 0.817073 |
61 | ADX | 0.495413 | 0.766667 |
62 | 3OD | 0.491667 | 0.888889 |
63 | MAP | 0.491379 | 0.823529 |
64 | 2SA | 0.491228 | 0.878049 |
65 | 50T | 0.490909 | 0.809524 |
66 | ACP | 0.490909 | 0.843373 |
67 | OAD | 0.487395 | 0.888889 |
68 | 6YZ | 0.486957 | 0.843373 |
69 | TAT | 0.486726 | 0.811765 |
70 | T99 | 0.486726 | 0.811765 |
71 | APR | 0.486486 | 0.864198 |
72 | AR6 | 0.486486 | 0.864198 |
73 | KAA | 0.483333 | 0.815217 |
74 | PR8 | 0.483333 | 0.939024 |
75 | B5V | 0.483333 | 0.833333 |
76 | 52H | 0.482759 | 0.744681 |
77 | 54H | 0.482759 | 0.752688 |
78 | VMS | 0.482759 | 0.752688 |
79 | RBY | 0.482143 | 0.855422 |
80 | ADV | 0.482143 | 0.855422 |
81 | AD9 | 0.482143 | 0.821429 |
82 | AGS | 0.482143 | 0.802326 |
83 | FYA | 0.479339 | 0.853659 |
84 | PTJ | 0.479339 | 0.825581 |
85 | ME8 | 0.479339 | 0.860465 |
86 | DLL | 0.478992 | 0.853659 |
87 | TSB | 0.478632 | 0.78022 |
88 | A5A | 0.478261 | 0.769231 |
89 | ANP MG | 0.478261 | 0.831325 |
90 | BEF ADP | 0.477876 | 0.797619 |
91 | 9X8 | 0.475 | 0.845238 |
92 | OOB | 0.474576 | 0.853659 |
93 | OZV | 0.474576 | 0.841463 |
94 | AYB | 0.473684 | 0.917647 |
95 | S4M | 0.472222 | 0.752809 |
96 | GSU | 0.471074 | 0.802198 |
97 | HQG | 0.470085 | 0.853659 |
98 | OMR | 0.469231 | 0.894118 |
99 | FA5 | 0.467742 | 0.878049 |
100 | B5Y | 0.467742 | 0.845238 |
101 | JNT | 0.466667 | 0.888889 |
102 | 00A | 0.466667 | 0.813953 |
103 | COD | 0.466667 | 0.896552 |
104 | 53H | 0.466102 | 0.744681 |
105 | A22 | 0.466102 | 0.831325 |
106 | YLB | 0.465649 | 0.928571 |
107 | ATF | 0.465517 | 0.811765 |
108 | VO4 ADP | 0.465517 | 0.8 |
109 | ALF ADP | 0.465517 | 0.761364 |
110 | 48N | 0.465116 | 0.891566 |
111 | YLP | 0.465116 | 0.951807 |
112 | G5A | 0.464912 | 0.802198 |
113 | ARG AMP | 0.464567 | 0.872093 |
114 | YSA | 0.464 | 0.763441 |
115 | 5AS | 0.463636 | 0.782609 |
116 | 3UK | 0.46281 | 0.843373 |
117 | LMS | 0.462264 | 0.747253 |
118 | 25A | 0.462185 | 0.819277 |
119 | 6V0 | 0.461538 | 0.825581 |
120 | SSA | 0.461538 | 0.802198 |
121 | NAI | 0.461538 | 0.813953 |
122 | IOT | 0.458647 | 0.895349 |
123 | A1R | 0.458333 | 0.902439 |
124 | NSS | 0.458333 | 0.782609 |
125 | A3R | 0.458333 | 0.902439 |
126 | LSS | 0.458333 | 0.765957 |
127 | LAQ | 0.457364 | 0.83908 |
128 | M2T | 0.456311 | 0.662921 |
129 | B5M | 0.456 | 0.845238 |
130 | ATP A A A | 0.456 | 0.807229 |
131 | ATP A | 0.456 | 0.807229 |
132 | JB6 | 0.455285 | 0.835294 |
133 | BIS | 0.455285 | 0.835294 |
134 | NVA LMS | 0.454545 | 0.776596 |
135 | YLC | 0.454545 | 0.927711 |
136 | LPA AMP | 0.453846 | 0.818182 |
137 | 5CA | 0.453782 | 0.802198 |
138 | AOC | 0.453704 | 0.714286 |
139 | GA7 | 0.453125 | 0.855422 |
140 | 25L | 0.451613 | 0.831325 |
141 | NAX | 0.450382 | 0.848837 |
142 | TAD | 0.449612 | 0.816092 |
143 | S7M | 0.449153 | 0.738636 |
144 | F2R | 0.448529 | 0.905882 |
145 | 9SN | 0.448 | 0.804598 |
146 | TXE | 0.44697 | 0.857143 |
147 | TYM | 0.44697 | 0.878049 |
148 | ADQ | 0.446281 | 0.865854 |
149 | AHZ | 0.446154 | 0.818182 |
150 | AP0 | 0.443609 | 0.804598 |
151 | BT5 | 0.442029 | 0.852273 |
152 | AR6 AR6 | 0.44186 | 0.819277 |
153 | 4UU | 0.44186 | 0.823529 |
154 | 8X1 | 0.441667 | 0.795699 |
155 | CNA | 0.441176 | 0.855422 |
156 | YLY | 0.439716 | 0.940476 |
157 | TXD | 0.439394 | 0.857143 |
158 | DND | 0.439394 | 0.855422 |
159 | 4UW | 0.439394 | 0.837209 |
160 | ADP BMA | 0.439024 | 0.843373 |
161 | 80F | 0.438849 | 0.820225 |
162 | H1Q | 0.438596 | 0.785714 |
163 | 5X8 | 0.438596 | 0.746988 |
164 | AMP DBH | 0.4375 | 0.8 |
165 | 4UV | 0.4375 | 0.823529 |
166 | WSA | 0.43609 | 0.771739 |
167 | 5N5 | 0.435644 | 0.753086 |
168 | P5A | 0.435484 | 0.826087 |
169 | J4G | 0.435484 | 0.890244 |
170 | BTX | 0.434783 | 0.840909 |
171 | YLA | 0.433824 | 0.905882 |
172 | KMQ | 0.433071 | 0.855422 |
173 | SXZ | 0.432 | 0.758621 |
174 | 5CD | 0.431373 | 0.698795 |
175 | AFH | 0.430769 | 0.837209 |
176 | ADN | 0.43 | 0.753086 |
177 | RAB | 0.43 | 0.753086 |
178 | XYA | 0.43 | 0.753086 |
179 | 3DH | 0.429907 | 0.694118 |
180 | DQV | 0.427481 | 0.853659 |
181 | GTA | 0.427481 | 0.797753 |
182 | LEU LMS | 0.427419 | 0.755319 |
183 | DSH | 0.427273 | 0.77381 |
184 | FB0 | 0.426667 | 0.88764 |
185 | D4F | 0.426573 | 0.797753 |
186 | K3E | 0.426357 | 0.732558 |
187 | SFG | 0.426087 | 0.756098 |
188 | AF3 ADP 3PG | 0.425373 | 0.795455 |
189 | ALF ADP 3PG | 0.425373 | 0.795455 |
190 | SMM | 0.425 | 0.733333 |
191 | MTA | 0.424528 | 0.694118 |
192 | SAM | 0.423729 | 0.719101 |
193 | NAQ | 0.423611 | 0.804598 |
194 | T5A | 0.423358 | 0.840909 |
195 | ADJ | 0.423358 | 0.850575 |
196 | NAD IBO | 0.422222 | 0.819277 |
197 | L3W | 0.422222 | 0.833333 |
198 | NAD TDB | 0.422222 | 0.819277 |
199 | 8PZ | 0.421875 | 0.782609 |
200 | N0B | 0.42069 | 0.905882 |
201 | 9K8 | 0.420635 | 0.686869 |
202 | 7D5 | 0.420561 | 0.764706 |
203 | G5P | 0.419847 | 0.804598 |
204 | 6MZ | 0.419643 | 0.807229 |
205 | EP4 | 0.419048 | 0.697674 |
206 | SA8 | 0.418803 | 0.755814 |
207 | A3D | 0.41844 | 0.843373 |
208 | 6RE | 0.418182 | 0.744186 |
209 | UP5 | 0.41791 | 0.823529 |
210 | A4D | 0.417476 | 0.731707 |
211 | A3P | 0.415929 | 0.817073 |
212 | DTA | 0.415094 | 0.686047 |
213 | EAD | 0.414966 | 0.827586 |
214 | 649 | 0.414815 | 0.787234 |
215 | NAJ PYZ | 0.413793 | 0.75 |
216 | G3A | 0.412214 | 0.804598 |
217 | 6IA | 0.411765 | 0.837209 |
218 | 4TC | 0.411765 | 0.825581 |
219 | DZD | 0.411348 | 0.858824 |
220 | K3K | 0.410853 | 0.72093 |
221 | J7C | 0.410714 | 0.752941 |
222 | KOY | 0.410448 | 0.761905 |
223 | A4P | 0.408759 | 0.802198 |
224 | AAT | 0.408333 | 0.755814 |
225 | EEM | 0.408333 | 0.719101 |
226 | 62X | 0.408 | 0.772727 |
227 | GJV | 0.40708 | 0.755814 |
228 | 7D3 | 0.40708 | 0.788235 |
229 | NAE | 0.406897 | 0.823529 |
230 | PAP | 0.40678 | 0.829268 |
231 | 4YB | 0.406015 | 0.784946 |
232 | NAJ PZO | 0.405594 | 0.784091 |
233 | CMX | 0.405405 | 0.908046 |
234 | 7D4 | 0.405172 | 0.788235 |
235 | OK8 | 0.404959 | 0.831325 |
236 | K15 | 0.404762 | 0.790698 |
237 | NAD | 0.404255 | 0.831325 |
238 | 4TA | 0.404255 | 0.808989 |
239 | AMP NAD | 0.404255 | 0.831325 |
240 | NWW | 0.403846 | 0.679012 |
241 | A2P | 0.403509 | 0.804878 |
242 | MAO | 0.403509 | 0.784091 |
243 | SAI | 0.403361 | 0.741176 |
244 | SAH | 0.403361 | 0.75 |
245 | A3G | 0.401786 | 0.802469 |
246 | NEC | 0.401786 | 0.731707 |
247 | A3T | 0.401709 | 0.777778 |
248 | 8Q2 | 0.40146 | 0.757895 |
249 | 0UM | 0.4 | 0.809524 |
250 | HAX | 0.4 | 0.88764 |
251 | V3L | 0.4 | 0.841463 |
252 | 3AM | 0.4 | 0.804878 |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | COA | 1 | 1 |
2 | 0T1 | 0.894737 | 0.976744 |
3 | DCA | 0.893805 | 0.954023 |
4 | COS | 0.887931 | 0.977012 |
5 | ETB | 0.877193 | 0.920455 |
6 | 30N | 0.871795 | 0.913979 |
7 | CAO | 0.871795 | 0.965909 |
8 | AMX | 0.871795 | 0.988235 |
9 | SCO | 0.864407 | 0.976744 |
10 | CMX | 0.864407 | 0.976744 |
11 | ACO | 0.857143 | 0.965909 |
12 | FCX | 0.857143 | 0.94382 |
13 | FAM | 0.857143 | 0.954545 |
14 | HAX | 0.85 | 0.954545 |
15 | FYN | 0.842975 | 1 |
16 | 3KK | 0.842975 | 0.977012 |
17 | OXK | 0.836066 | 0.977012 |
18 | KGP | 0.836066 | 0.885417 |
19 | SOP | 0.836066 | 0.977012 |
20 | YZS | 0.836066 | 0.885417 |
21 | COK | 0.836066 | 0.977012 |
22 | MCD | 0.836066 | 0.954545 |
23 | CA6 | 0.836066 | 0.885417 |
24 | 1VU | 0.829268 | 0.965909 |
25 | CMC | 0.829268 | 0.977012 |
26 | CO6 | 0.829268 | 0.977012 |
27 | NMX | 0.829268 | 0.903226 |
28 | CAJ | 0.822581 | 0.954545 |
29 | 2MC | 0.822581 | 0.934066 |
30 | SCD | 0.822581 | 0.976744 |
31 | 2CP | 0.81746 | 0.965909 |
32 | 3HC | 0.816 | 0.988372 |
33 | KGJ | 0.816 | 0.893617 |
34 | A1S | 0.816 | 0.977012 |
35 | MLC | 0.816 | 0.977012 |
36 | BCO | 0.816 | 0.977012 |
37 | IVC | 0.816 | 0.988372 |
38 | 1HE | 0.816 | 0.955056 |
39 | COD | 0.810345 | 0.988235 |
40 | CAA | 0.809524 | 0.988372 |
41 | MCA | 0.809524 | 0.965909 |
42 | SO5 | 0.809524 | 0.876289 |
43 | YE1 | 0.809524 | 0.965517 |
44 | COO | 0.809524 | 0.977012 |
45 | LCV | 0.809524 | 0.876289 |
46 | YXS | 0.80315 | 0.885417 |
47 | MC4 | 0.80315 | 0.923913 |
48 | YXR | 0.80315 | 0.885417 |
49 | SCA | 0.80315 | 0.977012 |
50 | KGA | 0.796875 | 0.884211 |
51 | HGG | 0.796875 | 0.977012 |
52 | BYC | 0.796875 | 0.977012 |
53 | 3CP | 0.796875 | 0.977012 |
54 | COW | 0.796875 | 0.965909 |
55 | CA8 | 0.796875 | 0.885417 |
56 | 1GZ | 0.796875 | 0.965909 |
57 | KFV | 0.796875 | 0.894737 |
58 | IRC | 0.796875 | 0.988372 |
59 | COF | 0.796875 | 0.955056 |
60 | 2KQ | 0.796875 | 0.955056 |
61 | 4CA | 0.790698 | 0.965909 |
62 | FAQ | 0.790698 | 0.977012 |
63 | BCA | 0.790698 | 0.965909 |
64 | HXC | 0.784615 | 0.955056 |
65 | GRA | 0.784615 | 0.977012 |
66 | 1CV | 0.781955 | 0.977012 |
67 | TGC | 0.778626 | 0.965909 |
68 | 1CZ | 0.772727 | 0.965909 |
69 | S0N | 0.772727 | 0.954545 |
70 | CO8 | 0.772727 | 0.955056 |
71 | 2NE | 0.772727 | 0.955056 |
72 | CIC | 0.772727 | 0.977012 |
73 | MYA | 0.766917 | 0.955056 |
74 | 0FQ | 0.766917 | 0.977012 |
75 | DCC | 0.766917 | 0.955056 |
76 | 5F9 | 0.766917 | 0.955056 |
77 | UCC | 0.766917 | 0.955056 |
78 | MFK | 0.766917 | 0.955056 |
79 | ST9 | 0.766917 | 0.955056 |
80 | 4CO | 0.766917 | 0.965909 |
81 | 01A | 0.761194 | 0.934066 |
82 | 0ET | 0.761194 | 0.955056 |
83 | CS8 | 0.755556 | 0.944444 |
84 | WCA | 0.755556 | 0.955056 |
85 | NHW | 0.75 | 0.955056 |
86 | HDC | 0.75 | 0.955056 |
87 | NHM | 0.75 | 0.955056 |
88 | 4KX | 0.75 | 0.944444 |
89 | UOQ | 0.75 | 0.955056 |
90 | HFQ | 0.744526 | 0.955056 |
91 | MRS | 0.744526 | 0.955056 |
92 | MRR | 0.744526 | 0.955056 |
93 | J5H | 0.73913 | 0.977012 |
94 | YNC | 0.73913 | 0.965909 |
95 | DAK | 0.73913 | 0.944444 |
96 | COA FLC | 0.736 | 0.965116 |
97 | 8Z2 | 0.733813 | 0.944444 |
98 | NHQ | 0.723404 | 0.988372 |
99 | F8G | 0.715278 | 0.913979 |
100 | 1HA | 0.713287 | 0.955056 |
101 | 01K | 0.708333 | 0.977012 |
102 | COT | 0.703448 | 0.977012 |
103 | CCQ | 0.695652 | 0.934066 |
104 | CA3 | 0.693878 | 0.977012 |
105 | 7L1 | 0.692308 | 0.965909 |
106 | RMW | 0.682119 | 0.955056 |
107 | CA5 | 0.671053 | 0.934066 |
108 | 93P | 0.666667 | 0.965909 |
109 | UCA | 0.666667 | 0.955056 |
110 | CO7 | 0.664234 | 0.977012 |
111 | N9V | 0.647887 | 0.922222 |
112 | 93M | 0.64557 | 0.965909 |
113 | OXT | 0.634146 | 0.913979 |
114 | 4BN | 0.607143 | 0.913979 |
115 | 5TW | 0.607143 | 0.913979 |
116 | BUA COA | 0.605634 | 0.943182 |
117 | PAP | 0.603604 | 0.811765 |
118 | JBT | 0.598837 | 0.894737 |
119 | BSJ | 0.592814 | 0.944444 |
120 | 6NA COA | 0.585034 | 0.922222 |
121 | HMG | 0.581081 | 0.943182 |
122 | MYR COA | 0.573333 | 0.922222 |
123 | EO3 COA | 0.573333 | 0.922222 |
124 | DAO COA | 0.573333 | 0.922222 |
125 | DCR COA | 0.573333 | 0.922222 |
126 | X90 COA | 0.573333 | 0.922222 |
127 | DKA COA | 0.573333 | 0.922222 |
128 | PLM COA | 0.573333 | 0.922222 |
129 | A3P | 0.54955 | 0.8 |
130 | PPS | 0.547009 | 0.752688 |
131 | ASP ASP ASP ILE NH2 CMC | 0.536585 | 0.932584 |
132 | 0WD | 0.521739 | 0.788889 |
133 | SFC | 0.490683 | 0.955056 |
134 | RFC | 0.490683 | 0.955056 |
135 | ACE SER ASP ALY THR NH2 COA | 0.483333 | 0.932584 |
136 | 3AM | 0.482143 | 0.788235 |
137 | PTJ | 0.48062 | 0.872093 |
138 | MET VAL ASN ALA CMC | 0.480447 | 0.932584 |
139 | 4PS | 0.477477 | 0.682353 |
140 | 5AD NJS | 0.47619 | 0.913043 |
141 | A22 | 0.468254 | 0.813953 |
142 | A2D | 0.465517 | 0.802326 |
143 | PUA | 0.462585 | 0.820225 |
144 | PAJ | 0.460938 | 0.883721 |
145 | HQG | 0.460317 | 0.813953 |
146 | ATR | 0.459016 | 0.8 |
147 | AGS | 0.459016 | 0.806818 |
148 | 3OD | 0.458015 | 0.825581 |
149 | ADP | 0.453782 | 0.823529 |
150 | 9BG | 0.451389 | 0.788889 |
151 | A2R | 0.448819 | 0.813953 |
152 | 8LE | 0.448 | 0.848837 |
153 | ACE MET LEU GLY PRO NH2 COA | 0.447917 | 0.932584 |
154 | UBG | 0.447853 | 0.844444 |
155 | BA3 | 0.445378 | 0.802326 |
156 | OAD | 0.442748 | 0.825581 |
157 | NA7 | 0.442748 | 0.858824 |
158 | ATP | 0.442623 | 0.823529 |
159 | HEJ | 0.442623 | 0.823529 |
160 | AP5 | 0.441667 | 0.802326 |
161 | B4P | 0.441667 | 0.802326 |
162 | 5FA | 0.439024 | 0.823529 |
163 | 2A5 | 0.439024 | 0.847059 |
164 | APR | 0.439024 | 0.802326 |
165 | AR6 | 0.439024 | 0.802326 |
166 | AQP | 0.439024 | 0.823529 |
167 | AT4 | 0.438017 | 0.816092 |
168 | AN2 | 0.438017 | 0.813953 |
169 | 48N | 0.435714 | 0.808989 |
170 | JNT | 0.435115 | 0.847059 |
171 | M33 | 0.434426 | 0.813953 |
172 | QA7 | 0.434109 | 0.848837 |
173 | 8LQ | 0.434109 | 0.837209 |
174 | 9X8 | 0.431818 | 0.806818 |
175 | SRP | 0.429688 | 0.837209 |
176 | ANP | 0.428571 | 0.804598 |
177 | ADQ | 0.427481 | 0.804598 |
178 | YLB | 0.426573 | 0.908046 |
179 | YLP | 0.425532 | 0.886364 |
180 | 5AL | 0.425197 | 0.813953 |
181 | 7D3 | 0.425 | 0.793103 |
182 | AD9 | 0.424 | 0.804598 |
183 | APU | 0.423611 | 0.786517 |
184 | CA0 | 0.422764 | 0.804598 |
185 | 7D4 | 0.422764 | 0.793103 |
186 | 25L | 0.422222 | 0.813953 |
187 | ATF | 0.421875 | 0.795455 |
188 | F2R | 0.421769 | 0.865169 |
189 | NJP | 0.421769 | 0.806818 |
190 | A2P | 0.421488 | 0.788235 |
191 | 8QN | 0.419847 | 0.813953 |
192 | PNS | 0.419643 | 0.682353 |
193 | ACP | 0.419355 | 0.825581 |
194 | KG4 | 0.419355 | 0.804598 |
195 | 8LH | 0.418605 | 0.837209 |
196 | J4G | 0.41791 | 0.848837 |
197 | NDP | 0.417808 | 0.788889 |
198 | ACQ | 0.417323 | 0.825581 |
199 | A1R | 0.416667 | 0.882353 |
200 | ATP A | 0.416058 | 0.770115 |
201 | ATP A A A | 0.416058 | 0.770115 |
202 | AMP | 0.415254 | 0.8 |
203 | A | 0.415254 | 0.8 |
204 | 1ZZ | 0.414815 | 0.842697 |
205 | TXA | 0.414815 | 0.816092 |
206 | FYA | 0.414815 | 0.813953 |
207 | NB8 | 0.414815 | 0.808989 |
208 | 00A | 0.413534 | 0.758242 |
209 | DLL | 0.413534 | 0.793103 |
210 | AHX | 0.413534 | 0.829545 |
211 | PAX | 0.412903 | 0.793478 |
212 | DQV | 0.411348 | 0.813953 |
213 | OMR | 0.409722 | 0.853933 |
214 | 9ZD | 0.409091 | 0.818182 |
215 | 25A | 0.409091 | 0.802326 |
216 | 9ZA | 0.409091 | 0.818182 |
217 | OOB | 0.409091 | 0.793103 |
218 | NPW | 0.408163 | 0.822222 |
219 | 6YZ | 0.407692 | 0.825581 |
220 | WAQ | 0.407407 | 0.860465 |
221 | TAT | 0.40625 | 0.816092 |
222 | T99 | 0.40625 | 0.816092 |
223 | 4AD | 0.406015 | 0.827586 |
224 | AMO | 0.406015 | 0.837209 |
225 | A3R | 0.406015 | 0.882353 |
226 | B5Y | 0.405797 | 0.786517 |
227 | FA5 | 0.405797 | 0.816092 |
228 | KMQ | 0.405797 | 0.795455 |
229 | TXP | 0.405405 | 0.829545 |
230 | 45A | 0.404959 | 0.781609 |
231 | ABM | 0.404959 | 0.781609 |
232 | PRX | 0.404762 | 0.825581 |
233 | ME8 | 0.404412 | 0.842697 |
234 | BIS | 0.404412 | 0.818182 |
235 | AFH | 0.404255 | 0.78022 |
236 | J7V | 0.403846 | 0.778947 |
237 | LQJ | 0.402878 | 0.781609 |
238 | NAI | 0.402778 | 0.777778 |
239 | ODP | 0.402685 | 0.78022 |
240 | DAL AMP | 0.401515 | 0.793103 |
241 | SRA | 0.4 | 0.784091 |
242 | ADX | 0.4 | 0.752688 |
243 | AU1 | 0.4 | 0.804598 |
No: | Ligand | Similarity coefficient |
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No: | Ligand | Similarity coefficient |
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